SCHEMBL3670622

SCHEMBL3670622

NC(=O)/C=C(\C(N)=O)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C19 P33261 2/20 0.50
TSHR P16473 2/20 0.50
TDP1 Q9NUW8 2/20 0.50
POLB P06746 2/20 0.50
MAPT P10636 2/20 0.50
CYP3A4 P08684 1/20 0.50
PARP1 P09874 1/20 0.50
RECQL P46063 1/20 0.50
BLM P54132 1/20 0.50
PMP22 Q01453 1/20 0.50
HSD17B10 Q99714 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
GAA P10253 1/20 0.45
AKR1C1 Q04828 1/20 0.45
NFE2L2 Q16236 1/20 0.43
ALDH1A1 P00352 4/20 0.42
CES2 O00748 2/20 0.42
CES1 P23141 2/20 0.42
DAO P14920 1/20 0.42
NAPRT Q6XQN6 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
SCHEMBL3670626 1.00 CYP2C19 (0.50) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL28364066 1.00 CYP2C19 (0.50) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL8764232 0.87 CYP2C19 (0.50) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL9248773 0.87 AKR1C1 (0.55) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL9248787 0.87 AKR1C1 (0.55) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL27541840 0.87 CYP2C19 (0.50) CYP2C19TSHRTDP1POLBMAPT
Ammonia Solution, Strong SCHEMBL28455562 0.85 AKR1C1 (0.53) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL7263596 0.85 PARP1 (0.41) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL7263609 0.85 PARP1 (0.41) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL29154091 0.85 NFE2L2 (0.57) CYP2C19TSHRTDP1POLBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0751177-B1 Stabilizers for high nitrile multipolymers STANDARD OIL CO (US) 2002-08-28 EP claimed
JP-60109562-A None JP disclosed
CN-106459541-B Process for preparing thermoplastic moulding compositions with improved mechanical properties 英力士苯领集团股份公司 2020-06-23 CN disclosed
EP-2166027-B1 POLYOLEFIN POLYMER HAVING POLAR GROUP, METHOD FOR PRODUCTION THEREOF, AND WATER DISPERSION MATERIAL AND MOLD RELEASE AGENT COMPOSITION MITSUI CHEMICALS INC (JP) 2015-06-10 EP disclosed
US-8513362-B2 Polyolefin polymer having polar group, method for production thereof, and water dispersion material and mold release agent composition MITSUI CHEMICALS, INC. (JP) 2013-08-20 US disclosed
US-20100113728-A1 POLYOLEFIN POLYMER HAVING POLAR GROUP, METHOD FOR PRODUCTION THEREOF, AND WATER DISPERSION MATERIAL AND MOLD RELEASE AGENT COMPOSITION MITSUI CHEMICALS, INC. 2010-05-06 US disclosed
EP-2166027-A1 POLYOLEFIN POLYMER HAVING POLAR GROUP, METHOD FOR PRODUCTION THEREOF, AND WATER DISPERSION MATERIAL AND MOLD RELEASE AGENT COMPOSITION Mitsui Chemicals, Inc. (JP) 2010-03-24 EP disclosed
CN-1409132-A Spacer plate for ink jet colour filter JSR CORP (JP) 2003-04-09 CN disclosed
CN-1314906-A Salts of paroxetine SMITHKLINE BEECHAM PLC (GB) 2001-09-26 CN disclosed
EP-0509459-B1 Maleimide-based copolymer,process for producing it, and thermoplastic resin composition containing the same NIPPON CATALYTIC CHEM IND (JP) 1997-07-16 EP disclosed
US-5478903-A Maleimide-based copolymer, process for producing it, and thermoplastic resin composition containing the same NIPPON SHOKUBAI CO., LTD. (JP) 1995-12-26 US disclosed
EP-0509459-A1 Maleimide-based copolymer,process for producing it, and thermoplastic resin composition containing the same NIPPON SHOKUBAI CO., LTD. (JP) 1992-10-21 EP disclosed
JP-S60109562-A PREPARATION OF N-SUBSTITUTED MONOMALEIMIDE DAIHACHI KAGAKU KOGYOSHO:KK 1985-06-15 JP disclosed