SCHEMBL3674773

SCHEMBL3674773

OC[CH]C(O)CO

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL6437357 0.80
SCHEMBL6438507 0.76
SCHEMBL10355874 0.76 LMNA (0.42)
SCHEMBL1717785 0.76
SCHEMBL11345995 0.74 AKR1B1 (0.38)
SCHEMBL270817 0.73
SCHEMBL3386161 0.73
SCHEMBL6434759 0.73
SCHEMBL2369749 0.72
SCHEMBL6433581 0.71 LMNA (0.44)

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 113 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7068197-B2 アプライド マテリアルズ インコーポレイテッド 2022-05-16 JP claimed
EP-1281405-B1 Short-chained peptide-dye conjugates as contrast agents for optical diagnosis DIAGNOSTIKFORSCHUNG INST (DE) 2009-01-21 EP claimed
EP-1176987-B1 SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS DIAGNOSTIKFORSCHUNG INST (DE) 2004-02-11 EP claimed
US-6630570-B1 Of tumor cells and tissues; derived from vaso-active intestinal protein, somatostatin or neurotensin; methine/cyanine; useful for endoscopy Insitut für Diagnostikforschung GmbH (DE) 2003-10-07 US claimed
EP-1281405-A2 Short-chained peptide-dye conjugates as contrast agents for optical diagnosis INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) 2003-02-05 EP claimed
US-20020176823-A1 1,4,7,10-tetraazacyclododecane butyltriols, processes for their production and pharmaceutical agents containing them BAYER INTELLECTUAL PROPERTY GMBH (DE) 2002-11-28 US claimed
CN-1351505-A Short-chain peptide dye conjagates used as contrast agents for optical diagnostics DIAGNOSTIKFORSCHUNG INST (DE) 2002-05-29 CN claimed
EP-1176987-A2 SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) 2002-02-06 EP claimed
WO-2000061194-A2 SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS Institut für Diagnostikforschung GmbH an der Freien Universität Berlin (DE) 2000-10-19 WO claimed
US-5980864-A 1,4,7,10-tetraazacyclododecane butyltriols, processes for their production and pharmaceutical agents containing them SCHERING AKTIENGELLSELLSCHAFT (DE) 1999-11-09 US claimed
US-5958373-A Polychelants as contrast enhancing agents NYCOMED SALUTAR INC. (US) 1999-09-28 US claimed
EP-0717737-B1 CHELANTS AS CONTRAST ENHANCING AGENTS NYCOMED SALUTAR INC (US) 1999-04-07 EP claimed
EP-0717737-A1 CHELANTS AS CONTRAST ENHANCING AGENTS NYCOMED SALUTAR, INC. (US) 1996-06-26 EP claimed
WO-1995007270-A1 CHELANTS AS CONTRAST ENHANCING AGENTS NYCOMED SALUTAR, INC. (US) 1995-03-16 WO claimed
EP-0530343-A1 WATER SOLUBLE, NON-IONIC X-RAY CONTRASTING AGENTS AND PROCESS FOR PRODUCING THE SAME. KOEHLER CHEMIE DR FRANZ (DE) 1993-03-10 EP claimed
WO-1992016498-A1 WATER SOLUBLE, NON-IONIC X-RAY CONTRASTING AGENTS AND PROCESS FOR PRODUCING THE SAME Dr. Franz Köhler Chemie GmbH (DE) 1992-10-01 WO claimed
US-5004835-A Substituted dicarboxylic acid-bis(3,5-dicarbamoyl-2,4,6-triiodoanilides), process for their production as well as X-ray contrast media containing them SCHERING AKTIENGESELLSCHAFT (DE) 1991-04-02 US claimed
EP-0033426-B1 TRIIODOBENZOYL DERIVATIVES USEFUL AS NON-IONIC CONTRAST MEDIA AND AMINO-DIOXEPANE INTERMEDIATES FOR THEIR SYNTHESIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1985-07-10 EP claimed
US-4341756-A Novel amino-dioxepane intermediates for the synthesis of new non-ionic contrast media THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1982-07-27 US claimed
CN-113423470-B Cosmetic compounding agent, cosmetic, and method for producing same 三吉油脂株式会社 2024-07-09 CN disclosed
US-20240057587-A1 ORGANIC AMMONIUM SALT AND HYDROGEN-BONDING MATERIAL TREATMENT AGENT USING SAME MIYOSHI OIL & FAT CO.,LTD. (JP) 2024-02-22 US disclosed
CN-114573521-B Preparation method of gadobutrol and intermediate thereof 威智医药股份有限公司 2023-10-27 CN disclosed
EP-3766969-B1 BIOCATALYST SOLVENT USING IONIC LIQUID, AND BIOCATALYST SOLUTION CONTAINING BIOCATALYST AND SAID SOLVENT MIYOSHI YUSHI KK (JP) 2023-10-04 EP disclosed
US-20220390458-A1 FLUORESCENT PROBE AND APPLICATIONS THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2022-12-08 US disclosed
CN-114573521-A Preparation method of gadobutrol and intermediate thereof 威智医药有限公司 2022-06-03 CN disclosed
CN-113423470-A Cosmetic compounding agent, cosmetic and method for producing same 三吉油脂株式会社 2021-09-21 CN disclosed
WO-2021058490-A2 FLUORESCENT PROBE AND APPLICATIONS THEREOF CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (CNRS) (FR) 2021-04-01 WO disclosed
EP-3795643-A1 FLUORESCENT PROBE AND APPLICATIONS THEREOF Centre National de la Recherche Scientifique (FR) 2021-03-24 EP disclosed
EP-3766969-A1 BIOCATALYST SOLVENT USING IONIC LIQUID, AND BIOCATALYST SOLUTION CONTAINING BIOCATALYST AND SAID SOLVENT Miyoshi Oil & Fat Co., Ltd. (JP) 2021-01-20 EP disclosed
EP-3130670-B1 BIOCATALYST SOLVENT USING IONIC LIQUID, AND BIOCATALYST SOLUTION CONTAINING BIOCATALYST AND SAID SOLVENT MIYOSHI YUSHI KK (JP) 2020-10-21 EP disclosed
US-10240141-B2 Biocatalyst solvent using ionic liquid, and biocatalyst solution containing biocatalyst and said solvent MIYOSHI OIL & FAT CO., LTD. (JP) 2019-03-26 US disclosed
EP-3130670-A1 BIOCATALYST SOLVENT USING IONIC LIQUID, AND BIOCATALYST SOLUTION CONTAINING BIOCATALYST AND SAID SOLVENT Miyoshi Oil & Fat Co., Ltd. (JP) 2017-02-15 EP disclosed
US-20170029801-A1 BIOCATALYST SOLVENT USING IONIC LIQUID, AND BIOCATALYST SOLUTION CONTAINING BIOCATALYST AND SAID SOLVENT MIYOSHI OIL & FAT CO., LTD. (JP) 2017-02-02 US disclosed
US-8703937-B2 Metal complexes of tetraazamacrocycle derivatives MALLINCKRODT LLC (US) 2014-04-22 US disclosed
US-8329065-B2 Carbon nanotube-containing composition, composite, and methods for producing them MITSUBISHI RAYON CO., LTD. (JP) 2012-12-11 US disclosed
US-20120277421-A1 Metal Complexes of Tetraazamacrocycle Derivatives MALLINCKRODT LLC (US) 2012-11-01 US disclosed
EP-1999118-B1 METAL COMPLEXES OF TETRAAZAMACROCYCLE DERIVATIVES MALLINCKRODT LLC (US) 2012-10-17 EP disclosed
US-8193347-B2 Metal complexes of tetraazamacrocycle derivatives MALLINCKRODT LLC (US) 2012-06-05 US disclosed
US-20100065788-A1 CARBON NANOTUBE-CONTAINING COMPOSITION, COMPOSITE, AND METHODS FOR PRODUCING THEM MITSUBISHI RAYON CO., LTD. (JP) 2010-03-18 US disclosed
CN-101400661-A Metal complexes of tetraazamacrocycle derivatives MALLINCKRODT INC (US) 2009-04-01 CN disclosed
US-20090036674-A1 Metal Complexes of Tetraazamacrocycle Derivatives MALLINCKRODT US POOL LLC 2009-02-05 US disclosed
EP-1281405-B1 Short-chained peptide-dye conjugates as contrast agents for optical diagnosis DIAGNOSTIKFORSCHUNG INST (DE) 2009-01-21 EP disclosed
EP-1999118-A2 METAL COMPLEXES OF TETRAAZAMACROCYCLE DERIVATIVES Mallinckrodt, Inc. (US) 2008-12-10 EP disclosed
WO-2008134289-A2 HIGH RELAXIVITY COORDINATIVELY UNSATURATED LANTHANIDE COMPLEXES MALLINCKRODT INC. (US) 2008-11-06 WO disclosed
WO-2007106546-A2 METAL COMPLEXES OF TETRAAZAMACROCYCLE DERIVATIVES MALLINCKRODT INC. (US) 2007-09-20 WO disclosed
US-7175953-B2 Short-warp peptide-dye conjugate as contrast agent for optical diagnostic INSTITUTE FUER DIAGNOSTIK FORSCHUNG (DE) 2007-02-13 US disclosed
EP-0983227-B1 PREPARATION OF TRI-IODO BENZENE COMPOUNDS AMERSHAM HEALTH AS (NO) 2006-08-30 EP disclosed
US-20060078503-A1 1,4,7,10-Tetraazacyclododecane butyltriols, processes for their production and pharmaceutical agents containing them PLATZEK JOHANNES 2006-04-13 US disclosed
US-20060036072-A1 Short-warp peptide dye conjugate as contrast agent for optical diagnostic INSTITUT FUR DIAGNOSTIKFORSCHUNG GMBH (DE) 2006-02-16 US disclosed
EP-1172400-B1 THERMOPLASTIC RESIN FILM WITH SATISFACTORY PRINTABILITY YUPO CORP (JP) 2005-12-28 EP disclosed
US-RE38856-E1 Preparation of tri-iodo benzene compounds AMERSHAM HEALTH AS (NO) 2005-10-25 US disclosed
US-6951639-B2 1,4,7,10-tetraazacyclododecane butyltriols, processes for their production and pharmaceutical agents containing them SCHERING AG (DE) 2005-10-04 US disclosed
EP-1176987-B1 SHORT-CHAIN PEPTIDE DYE CONJUGATES USED AS CONTRAST AGENTS FOR OPTICAL DIAGNOSTICS DIAGNOSTIKFORSCHUNG INST (DE) 2004-02-11 EP disclosed
US-6630570-B1 Of tumor cells and tissues; derived from vaso-active intestinal protein, somatostatin or neurotensin; methine/cyanine; useful for endoscopy Insitut für Diagnostikforschung GmbH (DE) 2003-10-07 US disclosed
US-6586106-B2 Ink transfer, adhesion and aging stability, and being satisfactory in back ghost when offset printing using oxidation polymerization type ink is performed on both faces YUPO CORPORATION (JP) 2003-07-01 US disclosed
EP-1281405-A2 Short-chained peptide-dye conjugates as contrast agents for optical diagnosis INSTITUT FÜR DIAGNOSTIKFORSCHUNG GmbH AN DER FREIEN UNIVERSITÄT BERLIN (DE) 2003-02-05 EP disclosed
US-20020176823-A1 1,4,7,10-tetraazacyclododecane butyltriols, processes for their production and pharmaceutical agents containing them BAYER INTELLECTUAL PROPERTY GMBH (DE) 2002-11-28 US disclosed
EP-0984922-B1 PREPARATION OF TRI-IODO BENZENE COMPOUNDS NYCOMED IMAGING AS (NO) 2002-08-07 EP disclosed
US-6399043-B1 RADIOLABELED MACROCYCLIC GADOLINIUM COMPLEXES WITH SUBSTANTIALLY BETTER NEURAL COMPATIBILITY; ENHANCED SIGNAL INTENSITY FOR NUCLEAR SPIN TOMOGRAPHY; WATER SOLUBILITY AND LOW OSMOLALITY; STABLE; NMR; RADIOIMAGING SCHERING AKTIENGESELLSCHAFT (DE) 2002-06-04 US disclosed
CN-1351505-A Short-chain peptide dye conjagates used as contrast agents for optical diagnostics DIAGNOSTIKFORSCHUNG INST (DE) 2002-05-29 CN disclosed
US-20020054991-A1 Thermoplastic resin film satisfactory in printability YUPO CORPORATION (JP) 2002-05-09 US disclosed
EP-1186305-A1 New brominated compounds as contrast media for X-ray mammography Schering Aktiengesellschaft (DE) 2002-03-13 EP disclosed
EP-1172400-A1 THERMOPLASTIC RESIN FILM WITH SATISFACTORY PRINTABILITY Yupo Corporation (JP) 2002-01-16 EP disclosed
US-6274762-B1 Preparation of tri-iodo benzene compounds NYCOMED IMAGING AS (NO) 2001-08-14 US disclosed
US-6137006-A IODINATING 2,4,6-UNSUBSTITUTED BENZENE RING CONTAINING COMPOUND WITH IODINE HALIDE IODINATING AGENT IN AQUEOUS REACTION MEDIUM, ADDING BASE, REDUCING AGENT AND AGITATING; ADDING SEED CRYSTALS; COOLING, PRECIPITATING REACTION PRODUCT NYCOMED IMAGING AS (NO) 2000-10-24 US disclosed
EP-0984922-A1 PREPARATION OF TRI-IODO BENZENE COMPOUNDS NYCOMED IMAGING AS (NO) 2000-03-15 EP disclosed
US-5980864-A 1,4,7,10-tetraazacyclododecane butyltriols, processes for their production and pharmaceutical agents containing them SCHERING AKTIENGELLSELLSCHAFT (DE) 1999-11-09 US disclosed
US-5958373-A Polychelants as contrast enhancing agents NYCOMED SALUTAR INC. (US) 1999-09-28 US disclosed
US-5911252-A Automated syringe filling system for radiographic contrast agents and other injectable substances CASSEL DOUGLAS (US) 1999-06-15 US disclosed
EP-0717737-B1 CHELANTS AS CONTRAST ENHANCING AGENTS NYCOMED SALUTAR INC (US) 1999-04-07 EP disclosed
EP-0901474-A1 ARYL PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1999-03-17 EP disclosed
WO-1998052908-A1 PREPARATION OF TRI-IODO BENZENE COMPOUNDS NYCOMED IMAGING AS (NO) 1998-11-26 WO disclosed
WO-1997044326-A1 ARYL PYRIMIDINE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 1997-11-27 WO disclosed
EP-0571593-B1 NEW NON IONIC IODIZED AGENTS FOR X-RAY CONTRASTING, METHOD FOR PREPARING THEM AND GALENICAL COMPOSITIONS CONTAINING THEM INVEST JUSTESA IMAGEN S A CENT (ES) 1996-10-30 EP disclosed
EP-0717737-A1 CHELANTS AS CONTRAST ENHANCING AGENTS NYCOMED SALUTAR, INC. (US) 1996-06-26 EP disclosed
EP-0530343-B1 WATER SOLUBLE, NON-IONIC X-RAY CONTRASTING AGENTS AND PROCESS FOR PRODUCING THE SAME KOEHLER CHEMIE DR FRANZ (DE) 1995-09-20 EP disclosed
US-5419894-A Complexing agents, complexes and complex salts SCHERING AKTIENGESELLSCHAFT (DE) 1995-05-30 US disclosed
WO-1995011044-A1 MANGANESE CHELATE CONTRAST AGENTS NYCOMED IMAGING A/S (NO) 1995-04-27 WO disclosed
WO-1995007270-A1 CHELANTS AS CONTRAST ENHANCING AGENTS NYCOMED SALUTAR, INC. (US) 1995-03-16 WO disclosed
EP-0637252-A1 NHR CONTRAST AGENTS COCKBAIN, Julian Roderick Michaelson (GB) 1995-02-08 EP disclosed
EP-0447013-B1 Fluorobenzene sulphonamides SCHERING AG (DE) 1994-08-03 EP disclosed
US-5316756-A Administering contrast medium of carboxyamine containing compounds SCHERING AKTIENGESELLSCHAFT (DE) 1994-05-31 US disclosed
EP-0368429-B1 Fluor-substituted benzene derivatives SCHERING AG (DE) 1994-02-09 EP disclosed
EP-0579261-A1 Fluorosubstituted benzene derivatives SCHERING AKTIENGESELLSCHAFT (DE) 1994-01-19 EP disclosed
US-5266673-A Compatibilizer for polymer blends and alloys MITSUBISHI PETROCHEMICAL CO., LTD. (JP) 1993-11-30 US disclosed
WO-1993021960-A1 NHR CONTRAST AGENTS NYCOMED IMAGING AS (NO) 1993-11-11 WO disclosed
US-5210290-A NMR diagnostic aid SCHERING AKTIENGESELLSCHAFT (DE) 1993-05-11 US disclosed
EP-0530442-A1 Process for producing a hydroxy-substituted poly (phenylene ether) resin MITSUBISHI CHEMICAL CORPORATION (JP) 1993-03-10 EP disclosed
EP-0530343-A1 WATER SOLUBLE, NON-IONIC X-RAY CONTRASTING AGENTS AND PROCESS FOR PRODUCING THE SAME. KOEHLER CHEMIE DR FRANZ (DE) 1993-03-10 EP disclosed
WO-1992016498-A1 WATER SOLUBLE, NON-IONIC X-RAY CONTRASTING AGENTS AND PROCESS FOR PRODUCING THE SAME Dr. Franz Köhler Chemie GmbH (DE) 1992-10-01 WO disclosed
EP-0255471-B1 1,4,7,10-TETRAAZACYCLODODECANE-DERIVATIVES SCHERING AKTIENGESELLSCHAFT (DE) 1992-09-09 EP disclosed
US-5130119-A Sulfonamide or hydroxy fluorine substituted benzene for medical diagnosis SCHERING AKTIENGESELLSCHAFT (DE) 1992-07-14 US disclosed
US-5073362-A DICARBOXYLIC ACID-BIS(3,5-DICARBAMOYL-2,4,6-TRIIODOANILIDES) AND X-RAY CONTRAST MEDIA CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1991-12-17 US disclosed
EP-0447013-A1 Fluorobenzene sulphonamides SCHERING AKTIENGESELLSCHAFT (DE) 1991-09-18 EP disclosed
US-5047228-A X-ray contrast; medical diagnosis SCHERING AKTIENGESELLSCHAFT (DE) 1991-09-10 US disclosed
US-5004835-A Substituted dicarboxylic acid-bis(3,5-dicarbamoyl-2,4,6-triiodoanilides), process for their production as well as X-ray contrast media containing them SCHERING AKTIENGESELLSCHAFT (DE) 1991-04-02 US disclosed
US-4925652-A NUCLEAR MAGNETIC RESONANCE SCHERING AKTIENGESELLSCHAFT (DE) 1990-05-15 US disclosed
US-4845090-A NUCLEAR MAGNETIC RESONANCE SCHERING AKTIENGESELLSCHAFT (DE) 1989-07-04 US disclosed
US-4826673-A Methods and compositions for enhancing magnetic resonance imaging MALLINCKRODT, INC. (US) 1989-05-02 US disclosed
EP-0250358-A2 Novel complex compounds SCHERING AKTIENGESELLSCHAFT (DE) 1987-12-23 EP disclosed
EP-0033426-B1 TRIIODOBENZOYL DERIVATIVES USEFUL AS NON-IONIC CONTRAST MEDIA AND AMINO-DIOXEPANE INTERMEDIATES FOR THEIR SYNTHESIS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1985-07-10 EP disclosed
EP-0130934-A1 Complexing agents, complexes and complex salts SCHERING AKTIENGESELLSCHAFT (DE) 1985-01-09 EP disclosed
US-4439613-A Novel amino-dioxepane intermediates for the synthesis of new non-ionic contrast media THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1984-03-27 US disclosed
US-4426371-A Novel N-hydroxyalkylated dicarboxylic acid bis(3,5-dicarbamoyl-2,4,6-triiodoanilides), as X-ray contrast media SCHERING, AKTIENGESELLSCHAFT (DE) 1984-01-17 US disclosed
US-4389526-A Intermediates and synthesis of 2-amino-2-deoxytetritols THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1983-06-21 US disclosed
EP-0022504-B1 1-N-ALKYLSISOMICIN DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINES BAYER AG (DE) 1983-03-16 EP disclosed
EP-0019843-B1 SISOMICIN DERIVATIVES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS MEDICINES BAYER AG (DE) 1982-09-29 EP disclosed
US-4341756-A Novel amino-dioxepane intermediates for the synthesis of new non-ionic contrast media THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1982-07-27 US disclosed
US-4335114-A 1-N-Alkylsisomicin derivatives, their production and their medicinal use BAYER AKTIENGESELLSCHAFT (DE) 1982-06-15 US disclosed
US-4312859-A ANTIBIOTICS, BACTERICIDES BAYER AKTIENGESELLSCHAFT (DE) 1982-01-26 US disclosed
EP-0033426-A2 Triiodobenzoyl derivatives useful as non-ionic contrast media and amino-dioxepane intermediates for their synthesis THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 1981-08-12 EP disclosed
EP-0022504-A1 1-N-alkylsisomicin derivatives, process for their preparation and their use as medicines BAYER AG (DE) 1981-01-21 EP disclosed
US-4226609-A FERTILIZERS, DENITRIFICATION OLIN CORPORATION (US) 1980-10-07 US disclosed
US-4226609-A FERTILIZERS, DENITRIFICATION OLIN CORPORATION (US) 1980-10-07 US disclosed