SCHEMBL88563

SCHEMBL88563

C=CCc1ccccc1CCCCC

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIPG Q9Y5X9 1/20 0.50
THRA P10827 1/20 0.49
THRB P10828 1/20 0.49
NR1H2 P55055 1/20 0.41
NR1H3 Q13133 1/20 0.41
ALOX5 P09917 1/20 0.41
PTGS2 P35354 1/20 0.41
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
BID P55957 3/20 0.39
MCL1 Q07820 3/20 0.39
BCL2L1 Q07817 2/20 0.39
BAK1 Q16611 2/20 0.39
KAT8 Q9H7Z6 2/20 0.39
TLR8 Q9NR97 1/20 0.39
PPARG P37231 1/20 0.39
PPARA Q07869 1/20 0.39
EP300 Q09472 1/20 0.39
KAT2A Q92830 1/20 0.39
KAT2B Q92831 1/20 0.39

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
Ammonia Solution, Strong SCHEMBL28810899 0.98 LIPG (0.49) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL27462871 0.98 LIPG (0.53) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL4787984 0.98 LIPG (0.53) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL5181489 0.96 LIPG (0.51) LIPGTHRATHRBNR1H2NR1H3
Cyanide SCHEMBL27334716 0.95 LIPG (0.46) LIPGTHRATHRBNR1H2NR1H3
SCHEMBL7188788 0.94 CYP3A4 (0.44) LIPGTHRATHRBGABRA1GABRB2
Phenol SCHEMBL27974393 0.90 LIPG (0.46) LIPGTHRATHRBALOX5PTGS2
SCHEMBL7194166 0.86 GABRA1 (0.44) THRATHRBGABRA1GABRB2CYP2D6
2-Allylphenol SCHEMBL9616206 0.84 BID (0.48) LIPGTHRATHRBALOX5PTGS2
Phenol SCHEMBL27628770 0.84 GABRA1 (0.42) LIPGTHRATHRBALOX5PTGS2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112961662-A Wetting reversal agent, wetting reversal liquid and pressure flooding water injection method 杰瑞能源服务有限公司 2021-06-15 CN claimed
CN-108732865-A The forming method of photosensitive polymer combination, black column spacer, display device and black column spacer 东京应化工业株式会社 2018-11-02 CN claimed
CN-107849265-A Use upper conversion nano particle and the light accommodating intraocular lens of near-infrared (NIR) light 加州理工学院 2018-03-27 CN claimed
EP-1765264-B1 DENTAL COMPOSITION CONTAINING UNSATURATED CARBOSILANE CONTAINING COMPONENTS MINNESOTA MINING MFG GMBH (DE) 2015-08-19 EP claimed
US-20140057791-A1 Flowering Stimulant Composition Using Nitrobenzene DEVI CROP SCIENCE PRIVATE LIMITED (IN) 2014-02-27 US claimed
CN-101935522-B Preparation of long-chain alkyl acyl benzene sulfonic acid sodium salt and application thereof in enhancing oil recovery rate UNIV JIANGNAN 2012-11-21 CN claimed
JP-4801063-B2 2011-10-26 JP claimed
CN-101935522-A Preparation of long-chain alkyl acyl benzene sulfonic acid sodium salt and application thereof in enhancing oil recovery rate UNIV JIANGNAN 2011-01-05 CN claimed
JP-2008505944-A 2008-02-28 JP claimed
EP-1765264-A1 DENTAL COMPOSITION CONTAINING UNSATURATED CARBOSILANE CONTAINING COMPONENTS 3M Espe AG (DE) 2007-03-28 EP claimed
WO-2006005368-A1 DENTAL COMPOSITION CONTAINING UNSATURATED CARBOSILANE CONTAINING COMPONENTS 3M ESPE AG (DE) 2006-01-19 WO claimed
US-20050266997-A1 Flowering stimulant composition using nitrobenzene DEVI CROP SCIENCE PRIVATE LIMITED (IN) 2005-12-01 US claimed
EP-1492400-A2 FLOWERING STIMULANT COMPOSITION USING NITROBENZENE Devi Pesticides Private Limited (IN) 2005-01-05 EP claimed
WO-2003086049-A2 FLOWERING STIMULANT COMPOSITION USING NITROBENZENE DEVI PESTICIDES PRIVATE LIMITED (IN) 2003-10-23 WO claimed
CN-113811365-A Personal wash compositions and methods for achieving improved conditioning benefits 巴斯夫欧洲公司 2021-12-17 CN disclosed
US-10400564-B2 Staged steam extraction of in situ bitumen DOW GLOBAL TECHNOLOGIES LLC (US) 2019-09-03 US disclosed
CN-109715581-A Resin composition for interlayer film, film material for interlayer film, and method for producing laminated glass 日立化成株式会社 2019-05-03 CN disclosed
US-5354784-A Photoinitiators for cationically polymerizable compounds ARAKAWA KAGAKU KOGYO KABUSHIKI KAISHA (JP) 1994-10-11 US disclosed
US-4049492-A REFINING POLYOLEFIN FIBER, TREATING WITH HYDROPHILIC SURFACTANT PRESERVATIVE CHAMPION INTERNATIONAL CORPORATION (US) 1977-09-20 US disclosed
US-4049493-A REFINING POLYOLEFIN FIBER, TREATING WITH HYDROPHILIC SURFACTANT PRESERVATIVE CHAMPION INTERNATIONAL CORPORATION (US) 1977-09-20 US disclosed