SCHEMBL128517

SCHEMBL128517

CCC(=O)O[CH]C(C)C

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
SCHEMBL129808 0.81 ALDH1A1 (0.48)
SCHEMBL11041394 0.79 MEN1 (0.34)
SCHEMBL2907462 0.78 MMP1 (0.42)
SCHEMBL11473185 0.75 ALDH1A1 (0.31)
SCHEMBL10900063 0.75 ESR1 (0.32)
SCHEMBL4839246 0.73 ALDH1A1 (0.41)
SCHEMBL21488619 0.72 SOAT1 (0.33)
SCHEMBL28243943 0.71 TDP1 (0.38)
SCHEMBL2901049 0.71 ALDH1A1 (0.52)
SCHEMBL126951 0.71 ALDH1A1 (0.32)

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 278 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112424181-B Substituted condensed thiophenes as STING modulators 希泰克斯特私人有限公司 2024-02-27 CN claimed
CN-112424181-A Substituted condensed thiophenes as STING modulators 希泰克斯特私人有限公司 2021-02-26 CN claimed
US-8658639-B2 N-substituted-cyclic amino derivative DAINIPPON SUMITOMO PHARMA CO., LTD (JP) 2014-02-25 US claimed
US-20120122773-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE DAINIPPON SUMITOMO PHARMA CO., LTD. (JP) 2012-05-17 US claimed
EP-2447264-A1 N-SUBSTITUTED-CYCLIC AMINO DERIVATIVE Dainippon Sumitomo Pharma Co., Ltd. (JP) 2012-05-02 EP claimed
US-7452875-B2 Amidomethyl-substituted 1-(carboxyalkyl) cyclopentyl-carbonylamino-benzazepine-N-acetic acid compounds, process and intermediate products for their preparation and pharmaceutical compositions containing them SOLVAY PHARMACEUTICALS GMBH (DE) 2008-11-18 US claimed
US-7427611-B2 Amidomethyl-substituted 1-(carboxyalkyl)-cyclopentyl-carbonylamino-benzazepine-N-acetic acid compounds, process and intermediate products for their preparation and pharmaceutical compositions containing them SOLVAY PHARMACEUTICALS GMBH (DE) 2008-09-23 US claimed
US-7410962-B2 Amidomethyl-substituted 1-(carboxyalkyl) cyclopentyl-carbonylamino-benzazepine-N-acetic acid compounds, process and intermediate products for their preparation and pharmaceutical compositions containing them SOLVAY PHARMACEUTICALS GMBH (DE) 2008-08-12 US claimed
US-20080085889-A1 Amidomethyl-Substituted 1-(Carboxyalkyl) Cyclopentyl-Carbonylamino-Benzazepine-N-Acetic Acid Compounds, Process and Intermediate Products for Their Preparation and Pharmaceutical Compositions Containing Them SOLVAY PHARMACEUTICALS GMBH (DE) 2008-04-10 US claimed
US-20070265244-A1 AMIDOMETHYL-SUBSTITUTED 1-(CARBOXYALKYL) CYCLOPENTYL-CARBONYLAMINO-BENZAZEPINE-N-ACETIC ACID COMPOUNDS, PROCESS AND INTERMEDIATE PRODUCTS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM SOLVAY PHARMACEUTICALS GMBH (DE) 2007-11-15 US claimed
WO-1991008195-A1 N-(1-(2-CARBOXYETHYL)CYCLOALKYL CARBONYL)-BETA-ALANINE DERIVATIVES FOR PHARMACEUTICAL USE PFIZER LIMITED (GB) 1991-06-13 WO claimed
WO-1991007378-A1 CYCLOALKYL-SUBSTITUTED GLUTARAMIDE DIURETIC AGENTS PFIZER LIMITED (GB) 1991-05-30 WO claimed
EP-0358398-A1 Cycloalkyl-substituted glutaramide antihypertensive agents Pfizer Limited (GB) 1990-03-14 EP claimed
CN-1038096-A Application with the compound of treatment psychosis effect, the reagent that contains this compounds and treatment thereof and prevention central nervous system disorder HOECHST AG (DE) 1989-12-20 CN claimed
EP-0343911-A2 Cycloalkyl-substituted glutaramide diuretic agents Pfizer Limited (GB) 1989-11-29 EP claimed
EP-0342850-A1 Enantiomeric glutaramide diuretic agents Pfizer Limited (GB) 1989-11-23 EP claimed
EP-0331609-A2 Angiotensin converting enzyme inhibitors having psychotropic effects HOECHST AKTIENGESELLSCHAFT (DE) 1989-09-06 EP claimed
EP-0326974-A1 Amino acid amides with a psychotropic activity, processes for their preparation, compositions containing them and their use HOECHST AKTIENGESELLSCHAFT (DE) 1989-08-09 EP claimed
EP-0274234-A2 Spiro-subsituted glutaramide diuretic agents Pfizer Limited (GB) 1988-07-13 EP claimed
US-4563446-A ANTICOAGULANT, ANTISCHEMIC TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1986-01-07 US claimed