SCHEMBL43760

SCHEMBL43760

Nc1cccc2c1C(=O)N(O)C2=O

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PABPC1 P11940 2/20 0.55
HSPA1A P0DMV8 1/20 0.55
ERCC1 P07992 2/20 0.53
FEN1 P39748 2/20 0.53
ERCC4 Q92889 2/20 0.53
DPP4 P27487 1/20 0.51
KDM4E B2RXH2 11/20 0.51
KMT2A Q03164 5/20 0.51
MEN1 O00255 4/20 0.51
F2 P00734 1/20 0.51
ADORA2A P29274 3/20 0.50
PTPRC P08575 1/20 0.48
LMNA P02545 2/20 0.47
ALDH1A1 P00352 2/20 0.47
MAPT P10636 4/20 0.44
POLB P06746 2/20 0.44
CYP1A2 P05177 1/20 0.44
TSHR P16473 1/20 0.44
ALOX12 P18054 1/20 0.44
TDP1 Q9NUW8 1/20 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
SCHEMBL28098235 0.87 ANPEP (0.48) PABPC1HSPA1AERCC1FEN1ERCC4
SCHEMBL6269280 0.85 ANPEP (0.47) PABPC1HSPA1AERCC1FEN1ERCC4
SCHEMBL3220477 0.82 ERCC1 (0.52) PABPC1ERCC1FEN1ERCC4DPP4
SCHEMBL30643813 0.79 MAOA (0.54) PABPC1ERCC1FEN1ERCC4DPP4
SCHEMBL3211320 0.79 MAOA (0.54) PABPC1ERCC1FEN1ERCC4DPP4
SCHEMBL6656873 0.78 FEN1 (0.52) PABPC1HSPA1AERCC1FEN1ERCC4
SCHEMBL31405120 0.78 MAPT (0.56) PABPC1ERCC1FEN1ERCC4KDM4E
SCHEMBL9853616 0.78 ERCC1 (0.52) PABPC1ERCC1FEN1ERCC4KDM4E
SCHEMBL4407778 0.78 MAPT (0.56) PABPC1ERCC1FEN1ERCC4KDM4E
SCHEMBL767500 0.77 HSPA1A (0.56) PABPC1HSPA1ADPP4KDM4EKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114805043-A Preparation method and system of cyclopentanone 中国石油化工股份有限公司 2022-07-29 CN claimed
CN-114805042-A Method and system for preparing cyclopentanone and application thereof 中国石油化工股份有限公司 2022-07-29 CN claimed
CN-111635287-A Synthesis method of substituted phenol 安徽中羰碳一工业技术有限责任公司 2020-09-08 CN claimed
CN-111606784-A Synthetic method of 4, 4' -dihydroxybiphenyl 安徽中羰碳一工业技术有限责任公司 2020-09-01 CN claimed
US-9475916-B2 Process for curing surface-coating compositions ALLNEX AUSTRIA GMBH (AT) 2016-10-25 US claimed
US-20140356540-A1 PROCESS FOR CURING SURFACE-COATING COMPOSITIONS CYTEC AUSTRIA GMBH (AT) 2014-12-04 US claimed
EP-2655527-A1 PROCESS FOR CURING SURFACE-COATING COMPOSITIONS ALLNEX AUSTRIA GmbH (AT) 2013-10-30 EP claimed
WO-2012085016-A1 PROCESS FOR CURING SURFACE-COATING COMPOSITIONS CYTEC AUSTRIA GMBH (AT) 2012-06-28 WO claimed
EP-1966114-B1 SELECTIVE OXIDATION OF ALKYLBENZENES EXXONMOBIL CHEM PATENTS INC (US) 2010-11-17 EP claimed
CN-101389586-A Selective oxidation of alkylbenzenes EXXONMOBIL CHEM PATENTS INC (US) 2009-03-18 CN claimed
EP-1606447-A1 OXIDATION SYSTEM CONTAINING A MACROCYCLIC METAL COMPLEX, THE PRODUCTION THEREOF AND ITS USE Lanxess B.V. (NL) 2005-12-21 EP claimed
WO-2004083516-A1 OXIDATION SYSTEM CONTAINING A MACROCYCLIC METAL COMPLEX, THE PRODUCTION THEREOF AND ITS USE LANXESS B.V. (NL) 2004-09-30 WO claimed
US-6316639-B1 REACTING DICARBOXYLIC ACIDS OR ANHYDRIDES WITH A SALT OF HYDROXYL-AMINE IN SOLUTION SELECTED FROM HYDROXYLAMINE SULFATE, HYDROXYLAMINE NITRATE, HYDROXYLAMINE ACETATE, HYDROXYLAMINE TETRAFLUOROBORATE, HYDROXYLAMINE PHOSPHATE Consortium für elektrochemische Industrie GmbH (DE) 2001-11-13 US claimed
US-6297403-B1 OXIDATION OF A (DI)ARYL METHANE OR METHYLENE DERIVATIVE IN PRESENCE OF AN AMINE OXIDE OR HYDROXYAMINE DERIVATIVE MEDIATOR; BY-PRODUCT INHIBITION Consortium für elektrochemische Industrie GmbH (DE) 2001-10-02 US claimed
US-6169213-B1 REACTING A HETEROARYL METHANOL WITH AN OXIDANT AND A MEDIATOR CONTAINING AMINO OXIDE GROUP TO FORM HETEROARYL ALDEHYDE OR A HETEROARYL KETONE Consortium f{umlaut over (u)}r elektrochemische Industrie GmbH (DE) 2001-01-02 US claimed
EP-0913382-B1 Process for the preparation of aldehydes and ketones CONSORTIUM ELEKTROCHEM IND (DE) 2000-11-08 EP claimed
US-6069282-A REACTION OF VINYL-, ALKYNYL- OR ARYL-METHANOLS WITH THE AID OF A MEDIATOR AND AN OXIDANT, WHEREIN THE MEDIATOR IS SELECTED FROM THE GROUP OF THE ALIPHATIC, CYCLOALIPHATIC, HETEROCYCLIC OR AROMATIC NO OR NOH CONTAINING COMPOUNDS CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) 2000-05-30 US claimed
US-6023000-A Process for the preparation of aldehydes and ketones Consortium fur elektrochemisch Industrie GmbH (DE) 2000-02-08 US claimed
EP-0913382-A1 Process for the preparation of aldehydes and ketones Consortium für elektrochemische Industrie GmbH (DE) 1999-05-06 EP claimed
EP-0885868-A1 Oxidation-process for the production of aldehydes and ketones in the presence of nitrogen-containing compounds Consortium für elektrochemische Industrie GmbH (DE) 1998-12-23 EP claimed