SCHEMBL8764232

SCHEMBL8764232

NC(=O)C(=CC(=O)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
SCHEMBL27541840 1.00 CYP2C19 (0.50) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL3670626 0.87 CYP2C19 (0.50) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL3670622 0.87 CYP2C19 (0.50) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL28364066 0.87 CYP2C19 (0.50) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL29154091 0.85 NFE2L2 (0.57) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL28100792 0.84 PLA2G2A (0.61) TSHRL3MBTL1MAPK1KMT2ALMNA
SCHEMBL7121170 0.83 NQO2 (0.56) CYP2C19TDP1MAPTCYP3A4BLM
SCHEMBL7121173 0.83 NQO2 (0.56) CYP2C19TDP1MAPTCYP3A4BLM
SCHEMBL164580 0.82 AKR1C1 (0.59) CYP2C19TSHRTDP1POLBMAPT
SCHEMBL164579 0.82 AKR1C1 (0.59) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115594675-A Beta-carbalin-cinnamic acid skeleton derivative and preparation method and application thereof 西安医学院(CN) 2023-01-13 CN claimed
CN-1532566-B Radiation sensitive composition for color filter JSR CORP 2010-05-12 CN claimed
CN-115594675-A Beta-carbalin-cinnamic acid skeleton derivative and preparation method and application thereof 西安医学院(CN) 2023-01-13 CN disclosed
CN-115594675-A Beta-carbalin-cinnamic acid skeleton derivative and preparation method and application thereof 西安医学院(CN) 2023-01-13 CN 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-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