SCHEMBL97419

SCHEMBL97419

O=COc1ccc2ccccc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP1A2 P05177 1/20 0.52
CYP2A6 P11509 1/20 0.52
CA1 P00915 1/20 0.48
CA2 P00918 1/20 0.48
CA9 Q16790 1/20 0.48
GPR84 Q9NQS5 1/20 0.47
AGXT P21549 2/20 0.47
TDP1 Q9NUW8 2/20 0.46
PTPN7 P35236 1/20 0.46
MEN1 O00255 1/20 0.46
MAPT P10636 1/20 0.46
KMT2A Q03164 1/20 0.46
KDM4E B2RXH2 1/20 0.45
MAPK1 P28482 1/20 0.45
PPARG P37231 1/20 0.44
ALOX5 P09917 1/20 0.44
RELA Q04206 1/20 0.43
RAB9A P51151 1/20 0.43
PTGS1 P23219 1/20 0.42
GAA P10253 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
SCHEMBL19897083 0.93 CYP1A2 (0.45) CYP1A2CYP2A6CA1CA2CA9
SCHEMBL14876962 0.91 CYP1A2 (0.39) CYP1A2CYP2A6CA1CA2CA9
SCHEMBL8763499 0.91 CBFB (0.39) CYP1A2CYP2A6CA1CA2CA9
SCHEMBL28764686 0.81 CYP1A2 (0.57) CYP1A2CYP2A6KDM4ERAB9APTGS1
SCHEMBL1587526 0.80 CYP2A6 (0.56) CYP1A2CYP2A6CA1CA9KDM4E
SCHEMBL14585876 0.79 CYP1A2 (0.37) CYP1A2CYP2A6CA1CA2CA9
SCHEMBL11511855 0.78 NCEH1 (0.47) CYP1A2CYP2A6TDP1MEN1MAPT
SCHEMBL12457069 0.78 ALDH1A1 (0.46) CA1CA2CA9TDP1MEN1
SCHEMBL3167621 0.78 CYP1A2 (0.46) CYP1A2TDP1MEN1MAPTKMT2A
SCHEMBL4570685 0.78 CYP2A6 (0.54) CYP1A2CYP2A6CA9TDP1MEN1

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

Appears in 2062 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250212873-A1 VOLATILE HDAC INHIBITORS FOR THERAPEUTIC AND PLANT APPLICATIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-07-03 US claimed
EP-4482306-A1 VOLATILE HDAC INHIBITORS FOR THERAPEUTIC AND PLANT APPLICATIONS THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2025-01-01 EP claimed
EP-3816153-B1 HETEROCYCLIC COMPOUND AND USE THEREOF TAKEDA PHARMACEUTICALS CO (JP) 2023-10-18 EP claimed
WO-2023192424-A1 VOLATILE HD AC INHIBITORS FOR THERAPEUTIC AND PLANT APPLICATIONS CROSS-REFERENCE TO RELATED APPLICATION THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-10-05 WO claimed
CN-112203699-B Method for inhibiting odor generation 花王株式会社 2022-11-29 CN claimed
CN-112203699-A Method for inhibiting odor generation 花王株式会社 2021-01-08 CN claimed
CN-102558550-B Heat-resistant polyamide resin matrix material and preparation method thereof Daiichi Woolen Co.,Ltd. (KR) 2015-09-30 CN claimed
CN-102942552-B 3,11-disubstituted-14-aryl-14H-dibenzo[a,j]xanthene derivatives, preparation methods and uses thereof UNIV HARBIN MEDICAL 2015-06-24 CN claimed
CN-102627853-B High-temperature elastomer nylon and preparation method thereof KINGFA SCIENCE & TECHNOLOGY CO 2014-01-08 CN claimed
CN-102942552-A 3,11-disubstituted-14-aryl-14H-dibenzo[a,j]xanthene derivatives, preparation methods and uses thereof UNIV HARBIN MEDICAL 2013-02-27 CN claimed
US-5942365-A CHARGE ADJUVANT OF ALUMINUM SALT OF AN ACID; SMEARING, LOSS OF RESOLUTION AND LOSS OF DENSITY ELIMINATED OR MINIMIZED XEROX CORPORATION (US) 1999-08-24 US claimed
US-5830897-A AIDS THERAPY G. D. SEARLE & CO. (US) 1998-11-03 US claimed
EP-0656887-B1 HYDROXYETHYLAMINO SULFONAMIDES USEFUL AS RETROVIRAL PROTEASE INHIBITORS SEARLE & CO (US) 1998-10-28 EP claimed
EP-0666842-B1 HYDROXYETHYLAMINO SULFAMIC ACID DERIVATIVES USEFUL AS RETROVIRAL PROTEASE INHIBITORS SEARLE & CO (US) 1998-06-24 EP claimed
EP-0666842-A1 HYDROXYETHYLAMINO SULFAMIC ACID DERIVATIVES USEFUL AS RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE & CO. (US) 1995-08-16 EP claimed
EP-0656887-A1 HYDROXYETHYLAMINO SULFONAMIDES USEFUL AS RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE & CO. (US) 1995-06-14 EP claimed
WO-1994010134-A1 HYDROXYETHYLAMINO SULFAMIC ACID DERIVATIVES USEFUL AS RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE & CO. (US) 1994-05-11 WO claimed
WO-1994004492-A1 HYDROXYETHYLAMINO SULFONAMIDES USEFUL AS RETROVIRAL PROTEASE INHIBITORS G.D. SEARLE & CO. (US) 1994-03-03 WO claimed
EP-0180188-B1 A COMPOSITION FOR INCREASING THE ANTI-CANCER ACTIVITY OF AN ANTI-CANCER COMPOUND OTSUKA PHARMACEUTICAL CO., LTD. (JP) 1992-04-15 EP claimed
US-4057576-A Process for isolating 2-hydroxynaphthalene carboxylic acids from reaction mixtures of the alkali metal salts of 2-hydroxynaphthalene with carbon dioxide HOECHST AKTIENGESELLSCHAFT (DT) 1977-11-08 US claimed