SCHEMBL9561635

SCHEMBL9561635

CCCCCc1ccc(-c2ccccc2)c(F)c1

nearest known ligand 0.60

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RARB P10826 4/20 0.60
GPR3 P46089 1/20 0.50
PSMB5 P28074 1/20 0.49
HSD11B1 P28845 2/20 0.48
RARA P10276 1/20 0.47
RARG P13631 1/20 0.47
FAAH O00519 1/20 0.44
PTGS2 P35354 1/20 0.44
HTR2A P28223 1/20 0.43
GPR84 Q9NQS5 1/20 0.42

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL26193728 0.95 RARB (0.55) RARBGPR3PSMB5HSD11B1RARA
SCHEMBL9398982 0.90 RARB (0.68) RARBGPR3RARARARGPTGS2
SCHEMBL2909950 0.89 RARB (0.64) RARBGPR3HSD11B1RARARARG
SCHEMBL9223658 0.89 RARB (0.50) RARBGPR3PSMB5HSD11B1RARA
SCHEMBL10981922 0.89 RARB (0.70) RARBGPR3RARARARGPTGS2
SCHEMBL10974728 0.89 RARB (0.70) RARBGPR3RARARARGPTGS2
SCHEMBL10979477 0.89 RARB (0.70) RARBGPR3RARARARGPTGS2
SCHEMBL10975095 0.89 RARB (0.70) RARBGPR3RARARARGPTGS2
SCHEMBL10977018 0.89 RARB (0.70) RARBGPR3RARARARGPTGS2
SCHEMBL10976338 0.89 RARB (0.70) RARBGPR3RARARARGPTGS2

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 17 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-61246156-A None JP disclosed
CN-108251127-A Liquid crystal compound containing difluoromethoxy bridge bond and application thereof 北京八亿时空液晶科技股份有限公司 2018-07-06 CN disclosed
CN-108130101-A Liquid crystal compound containing difluoromethoxy bridge bond and application thereof 北京八亿时空液晶科技股份有限公司 2018-06-08 CN disclosed
CN-104513115-B The manufacture method of fluorine-containing aryl-linking compound 大金工业株式会社 2017-09-19 CN disclosed
CN-107011920-A Liquid crystal media comprising thiophene derivant 默克专利股份有限公司 2017-08-04 CN disclosed
CN-104837956-A Liquid-crystalline medium MERCK PATENT GMBH 2015-08-12 CN disclosed
CN-103571498-B CF2S bridged bond-containing liquid crystal monomeric compound and synthesis method XI AN CAIJING OPTO ELECTRICAL SCIENCE & TECHNOLOGY CO LTD 2015-06-17 CN disclosed
CN-104513115-A Process for producing fluorine-containing biaryl compound DAIKIN IND LTD 2015-04-15 CN disclosed
CN-104449761-A Liquid crystal compound containing difluoromethoxy bridge bond and application thereof JIANG ZHANYING 2015-03-25 CN disclosed
CN-104326952-A METHOD FOR PRODUCING PYRIDAZINONE COMPOUNDS AND INTERMEDIATE THEREOF SUMITOMO CHEMICAL CO 2015-02-04 CN disclosed
CN-104277004-A METHOD FOR PRODUCING PYRIDAZINONE COMPOUNDS AND INTERMEDIATE THEREOF SUMITOMO CHEMICAL CO 2015-01-14 CN disclosed
EP-0530338-A1 ANISOTROPIC ORGANIC COMPOUNDS THE SECRETARY OF STATE FOR DEFENCE IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN (GB) 1993-03-10 EP disclosed
EP-0215120-B1 CYCLOHEXANE DERIVATIVES MERCK PATENT GmbH (DE) 1989-08-23 EP disclosed
US-4846998-A LIQUID CRYSTALS, ESTERS, NITRILES; ETHERS, HYDROCARBONS MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1989-07-11 US disclosed
EP-0215120-A1 CYCLOHEXANE DERIVATIVES. MERCK PATENT GMBH (DE) 1987-03-25 EP disclosed
JP-S61246156-A 1-ACYLAMIDO-2-FLUORO-4-ACYLBENZENE AND PRODUCTION THEREOF SAGAMI CHEM RES CENTER 1986-11-01 JP disclosed
WO-1986005486-A1 CYCLOHEXANE DERIVATIVES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1986-09-25 WO disclosed