SCHEMBL50199

SCHEMBL50199

C=C(C(=C)c1ccccc1)c1ccccc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 3/20 0.47
CES2 O00748 2/20 0.47
TSHR P16473 2/20 0.47
DAO P14920 1/20 0.47
NAPRT Q6XQN6 1/20 0.47
ALDH1A1 P00352 1/20 0.47
MAOA P21397 2/20 0.44
MAOB P27338 2/20 0.44
AKT1 P31749 1/20 0.43
MAPT P10636 3/20 0.43
F2 P00734 2/20 0.43
CYP3A4 P08684 2/20 0.43
BLM P54132 2/20 0.43
TDP1 Q9NUW8 2/20 0.43
CA2 P00918 2/20 0.43
CA4 P22748 2/20 0.43
F10 P00742 1/20 0.43
F12 P00748 1/20 0.43
F7 P08709 1/20 0.43
F3 P13726 1/20 0.43

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
SCHEMBL8829796 0.97 MAPT (0.46) CES1CES2TSHRDAONAPRT
SCHEMBL14017960 0.87 CES1 (0.43) CES1CES2TSHRDAONAPRT
SCHEMBL7496266 0.84 CES1 (0.41) CES1CES2TSHRDAONAPRT
SCHEMBL9490920 0.82 CES2 (0.39) CES1CES2TSHRDAONAPRT
SCHEMBL9614957 0.82 CES2 (0.44) CES1CES2TSHRDAONAPRT
SCHEMBL24884761 0.82 CA12 (0.48) CES1CES2TSHRDAONAPRT
SCHEMBL892193 0.82 CES2 (0.44) CES1CES2TSHRDAONAPRT
SCHEMBL22080015 0.82 BLM (0.48) CES1CES2TSHRDAONAPRT
SCHEMBL3172363 0.82 ALDH1A1 (0.42) CES1CES2TSHRDAONAPRT
SCHEMBL535039 0.82 CES1 (0.52) CES1CES2TSHRDAONAPRT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118684820-B Salt-tolerant drag reducer of low molecular weight powder 北京易联结科技发展有限公司 2024-11-12 CN claimed
CN-118684820-A Salt-tolerant drag reducer of low molecular weight powder 北京易联结科技发展有限公司 2024-09-24 CN claimed
CN-117430868-A Core-shell flame retardant, functional composite material containing flame retardant, and preparation and application of functional composite material 中国石油化工股份有限公司 2024-01-23 CN claimed
EP-2694560-B1 TITANIUM-CATALYST SYSTEM COMPRISING SUBSTITUTED CYCLOPENTADIENYL, GUANIDINE AND DIENE LIGANDS Arlanxeo Netherlands Bv (NL) 2016-08-24 EP claimed
CN-103517923-B Titanium catalyst system containing substituted cyclopentadienyl, guanidine and diene ligands LANXESS ELASTOMERS B.V. (NL) 2016-05-11 CN claimed
US-9315594-B2 Titanium-catalyst system comprising substituted cyclopentadienyl, guanidine and diene ligands LANXESS ELASTOMERS B.V. (NL) 2016-04-19 US claimed
US-7803846-B2 Highly durable polymer electrolytic membrane for a fuel cell having a cross-linked structure JAPAN ATOMIC ENERGY AGENCY (JP) 2010-09-28 US claimed
US-20060134493-A1 Highly durable polymer electrolytic membrane for a fuel cell having a cross-linked structure JAPAN ATOMIC ENERGY AGENCY (JP) 2006-06-22 US claimed
US-6528671-B1 Such as cyclopentadienyl-trimethylphosphineimine-1,4-di-phenyl butandiene titanium complex; copolymerization of ethylene with other alpha-olefins SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2003-03-04 US claimed
EP-0802804-B1 Biodegradable polymer-containing compositions PROCTER & GAMBLE (US) 2002-04-03 EP claimed
WO-1996021475-A1 BIODEGRADABLE ARTICLES MADE FROM CERTAIN TRANS-POLYMERS AND BLENDS THEREOF WITH OTHER BIODEGRADABLE COMPONENTS THE PROCTER & GAMBLE COMPANY (US) 1996-07-18 WO claimed
US-5175213-A Rubber like styrene-butadiene-based polymer particles dispersed in styrene-based polymer; high izod/drop weight impact strength, stiffness and gloss IDEMITSU PETROCHEMICAL CO., LTD. (JP) 1992-12-29 US claimed
EP-0311689-B1 PROCESS FOR SELECTIVELY MONOHYDROFORMYLATING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-06-10 EP claimed
EP-0304495-B1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1992-05-27 EP claimed
US-4982007-A CARBONYLATION CATALYST NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1991-01-01 US claimed
US-4908473-A Reacting a (1-arylethenyl)vinylbenzene with carbon monoxide and water or alcohol in the presence of carbonylation catalyst NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1990-03-13 US claimed
EP-0311689-A1 PROCESS FOR SELECTIVELY MONOHYDROFORMYLATING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-04-19 EP claimed
EP-0304495-A1 PROCESS FOR SELECTIVELY MONOHYDROESTERIFYING DIOLEFIN NIPPON PETROCHEMICALS COMPANY, LIMITED (JP) 1989-03-01 EP claimed
US-4665257-A Facile, high yield synthesis of 2,3-diphenyl-1,3-butadiene THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF THE ARMY (US) 1987-05-12 US claimed
US-4183877-A High-impact polystyrene composition and production thereof ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1980-01-15 US claimed