SCHEMBL21295488

SCHEMBL21295488

NC(=O)c1ccc(N)cc1.Oc1cccc(-c2cccc(O)c2)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.58
HSD17B1 P14061 4/20 0.50
HSD17B2 P37059 4/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
PARP10 Q53GL7 1/20 0.50
HPGDS O60760 3/20 0.47
CA12 O43570 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA7 P43166 1/20 0.45
CA9 Q16790 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
CA14 Q9ULX7 1/20 0.45
PIK3CG P48736 1/20 0.45
HDAC1 Q13547 2/20 0.44
KDM1A O60341 1/20 0.44
HDAC6 Q9UBN7 1/20 0.44
MKNK1 Q9BUB5 2/20 0.44

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
SCHEMBL30958373 0.89 HSD17B1 (0.65) PARP1HSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL1788682 0.89 HSD17B1 (0.65) PARP1HSD17B1HSD17B2CYP3A4CYP2C9
3-Aminobenzamide SCHEMBL28623259 0.84 PARP1 (0.67) PARP1HSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL1147444 0.83 PARP1 (0.77) PARP1HSD17B1HSD17B2CYP3A4CYP2C9
SCHEMBL3790228 0.81 HSD17B1 (0.77) HSD17B1HSD17B2CYP3A4CYP2C9CA12
Urea SCHEMBL28406941 0.80 HSD17B1 (0.68) PARP1HSD17B1HSD17B2CYP3A4CYP2C9
Biphenyl SCHEMBL28602112 0.79 CYP3A4 (0.62) PARP1CYP3A4PARP10TDP1HDAC1
Benzene SCHEMBL28558933 0.78 PARP10 (0.68) PARP1CYP3A4CYP2C9PARP10ALDH1A1
Benzene SCHEMBL6865184 0.78 PARP10 (0.68) PARP1CYP3A4CYP2C9PARP10ALDH1A1
SCHEMBL56532 0.78 PARP10 (0.74) PARP1CYP3A4PARP10ALDH1A1CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117957268-A Polyimide and polyimide precursor UBE株式会社 2024-04-30 CN disclosed
CN-112368287-B Tetracarboxylic dianhydride, polyimide precursor resin, polyimide precursor resin solution, polyimide solution and polyimide film 引能仕株式会社 2024-01-09 CN disclosed
CN-110461818-B Imide oligomer, curing agent, adhesive, and method for producing imide oligomer 积水化学工业株式会社 2023-11-14 CN disclosed
CN-113383029-B Ester compound, resin composition, cured product, and laminate film 积水化学工业株式会社 2023-10-24 CN disclosed
CN-115023466-A Composite, slurry composition, film, and metal foil laminate 引能仕株式会社 2022-09-06 CN disclosed
CN-111742012-A Polyimide precursor resin composition 引能仕株式会社 2020-10-02 CN disclosed
CN-111448224-A Urea-bonded tetrafunctional (meth) acrylate compound and composition containing same 捷恩智株式会社 2020-07-24 CN disclosed
WO-2020027249-A1 TETRACARBOXYLIC DIANHYDRIDE, POLYIMIDE PRECURSOR RESIN, POLYIMIDE, POLYIMIDE PRECURSOR RESIN SOLUTION, POLYIMIDE SOLUTION, AND POLYIMIDE FILM JXTGエネルギー株式会社 2020-02-06 WO disclosed
WO-2019194108-A1 UREA-BINDING TETRAFUNCTIONAL (METH)ACRYLATE COMPOUND AND COMPOSITION CONTAINING SAME JNC株式会社 2019-10-10 WO disclosed
WO-2019194107-A1 RESIN COMPOSITION JNC株式会社 2019-10-10 WO disclosed
WO-2019181699-A1 RESIN, RESIN PRECURSOR AND RESIN PRECURSOR SOLUTION JXTGエネルギー株式会社 2019-09-26 WO disclosed
WO-2019163703-A1 POLYIMIDE PRECURSOR RESIN COMPOSITION JXTGエネルギー株式会社 2019-08-29 WO disclosed