SCHEMBL995931

SCHEMBL995931

C=CCCOCC

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
SCHEMBL7543229 0.95 TSHR (0.41)
SCHEMBL3119793 0.86
SCHEMBL979514 0.81 ALDH1A1 (0.45)
SCHEMBL3122068 0.81
SCHEMBL16744162 0.81 TSHR (0.48)
SCHEMBL76625 0.81
SCHEMBL1455213 0.80
SCHEMBL3114132 0.79 TSHR (0.54)
SCHEMBL3124662 0.79 TSHR (0.54)
SCHEMBL2528383 0.79 TSHR (0.54)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0941045-B1 IMPROVED HAIR CONDITIONING COMPOSITION COLGATE PALMOLIVE CO (US) 2003-02-26 EP claimed
EP-4201943-A1 BORON-CONTAINING COMPOUND AND ELECTROLYTE SOLUTION ADDITIVE FOR SECONDARY BATTERY INCLUDING THE SAME SK On Co., Ltd. (KR) 2023-06-28 EP disclosed
EP-4194461-A1 BORON-CONTAINING COMPOUND AND ELECTROLYTE SOLUTION ADDITIVE FOR SECONDARY BATTERY INCLUDING THE SAME SK On Co., Ltd. (KR) 2023-06-14 EP disclosed
CN-109790391-B Curable resin composition for forming easily peelable film and method for producing same 大阪有机化学工业株式会社 2022-04-12 CN disclosed
US-11220481-B2 Thermosetting ring-opening metathesis polymerization materials with thermally degradable linkages ISP INVESTMENTS LLC (US) 2022-01-11 US disclosed
US-20210395459-A1 THERMOSETTING RESIN COMPOSITION AND METHOD FOR MANUFACTURING SAME SAKAI CHEMICAL INDUSTRY CO., LTD. (JP) 2021-12-23 US disclosed
US-11180585-B2 Film touch sensor and structure including the same DONGWOO FINE-CHEM CO., LTD. (KR) 2021-11-23 US disclosed
CN-113594104-A Monolithic integrated chip and application thereof 南方科技大学 2021-11-02 CN disclosed
US-20210277156-A1 FILM TOUCH SENSOR AND STRUCTURE INCLUDING THE SAME DONGWOO FINE-CHEM CO., LTD. (KR) 2021-09-09 US disclosed
US-20210053977-A9 POTENT AGELASTATIN DERIVATIVES AS MODULATORS FOR CANCER INVASION AND METASTASIS MASSACHUSETTS INSTITUTE OF TECHNOLOGY (US) 2021-02-25 US disclosed
EP-0397037-B1 Use of polyoxyalkylene glycol derivative in lubricating oil for compression-type refrigerators. IDEMITSU KOSAN CO (JP) 1993-11-03 EP disclosed
US-5244597-A Liquid crystalline mixtures having a chiral tilted smectic phase HOFFMANN-LA ROCHE INC. (US) 1993-09-14 US disclosed
EP-0343487-B1 CYCLOHEXYL ESTERS OF ALPHA-FLUORO/CARBOXYLIC ACIDS F. HOFFMANN-LA ROCHE AG (CH) 1993-01-20 EP disclosed
EP-0397037-A2 Use of polyoxyalkylene glycol derivative in lubricating oil for compression-type refrigerators. IDEMITSU KOSAN COMPANY LIMITED (JP) 1990-11-14 EP disclosed
US-4522760-A SEPARATION USING NITROGEN, PHOSPHORUS, OR ARSENIC QUATERNARY ONIUMSALT, ALCOHOL, AND HYDROCARBON SOLVENT RHONE-POULENC CHIMIE DE BASE (FR) 1985-06-11 US disclosed
EP-0075524-B1 CARBONYLATION PROCESS OF CONJUGATED DIENES IN THE PRESENCE OF A PALLADIUM CATALYST WITH RECYCLING OF SAID CATALYST RHONE-POULENC CHIMIE DE BASE (FR) 1984-09-12 EP disclosed
US-4454333-A DISTILLATION WITH QUATERNARY PHOSPHONIUM, ARSONIUM OR AMMONIUM RHONE-POULENC CHIMIE DE BASE (FR) 1984-06-12 US disclosed
US-4433164-A HYDROHALIDE; PALLADIUM CATALYST; AMMONIUM, PHOSPHONIUM OR ARSONIUM COMPOUND RHONE-POULENC INDUSTRIES (FR) 1984-02-21 US disclosed
EP-0075524-A1 Carbonylation process of conjugated dienes in the presence of a palladium catalyst with recycling of said catalyst RHONE-POULENC CHIMIE DE BASE (FR) 1983-03-30 EP disclosed
US-4140514-A HERBICIDES CHEVRON RESEARCH COMPANY (US) 1979-02-20 US disclosed