SCHEMBL4521739

SCHEMBL4521739

O=C(O)c1ccc(Cc2ccccc2)c(C(=O)O)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.72
KDM4E B2RXH2 1/20 0.56
PTPN1 P18031 3/20 0.54
PTPN2 P17706 1/20 0.54
PTPN6 P29350 1/20 0.54
HNF4A P41235 1/20 0.49
CDC25A P30304 1/20 0.49
CDC25B P30305 1/20 0.49
HSD17B10 Q99714 1/20 0.49
CA1 P00915 1/20 0.47
CA2 P00918 1/20 0.47
CA9 Q16790 1/20 0.47
PLA2G10 O15496 1/20 0.46
PLA2G2A P14555 1/20 0.46
LMNA P02545 1/20 0.46
BCL2 P10415 1/20 0.46
BCL2L1 Q07817 1/20 0.46
CYP1A2 P05177 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45

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
SCHEMBL6772376 0.87 TSHR (0.69) TSHRKDM4EPTPN1PTPN2PTPN6
SCHEMBL7943165 0.86 TSHR (0.63) TSHRKDM4EPTPN1PTPN2PTPN6
SCHEMBL27595060 0.85 TSHR (0.54) TSHRKDM4EPTPN1PTPN2PTPN6
SCHEMBL31307947 0.85 TSHR (0.61) TSHRKDM4EPTPN1PTPN2PTPN6
SCHEMBL28129597 0.85 TSHR (0.61) TSHRKDM4EPTPN1PTPN2PTPN6
SCHEMBL27564097 0.85 TSHR (0.61) TSHRKDM4EPTPN1PTPN2PTPN6
SCHEMBL27624784 0.84 TSHR (0.53) TSHRKDM4EPTPN1PTPN2PTPN6
SCHEMBL27532002 0.84 TSHR (0.53) TSHRKDM4EPTPN1PTPN2PTPN6
SCHEMBL27542160 0.84 TSHR (0.53) TSHRKDM4EPTPN1PTPN2PTPN6
SCHEMBL27869431 0.84 TSHR (0.53) TSHRKDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-104418822-A Compound with xanthine oxidase inhibition activity, and use thereof NANJING HUAWE MEDICAL TECHNOLOGY DEV CO LTD 2015-03-18 CN claimed
CN-1216996-A Metallocene cocatalyst DOW CHEMICAL CO (US) 1999-05-19 CN claimed
WO-2023074754-A1 SEALANT FILM 大日本印刷株式会社 2023-05-04 WO disclosed
WO-2022261091-A1 GRAPHENE-POLYAMIDE COMPOSITE MEMBRANES AND MICROPARTICLES, METHODS OF MANUFACTURE, AND METHODS OF USE UNIVERSITY OF CONNECTICUT (US) 2022-12-15 WO disclosed
US-20220387940-A1 GRAPHENE-POLYAMIDE COMPOSITE MEMBRANES AND MICROPARTICLES, METHODS OF MANUFACTURE, AND METHODS OF USE NATIONAL SCIENCE FOUNDATION 2022-12-08 US disclosed
US-20190055403-A1 POLYAMIDE RESIN AND FILM COMPRISING THE SAME UBE INDUSTRIES, LTD. (JP) 2019-02-21 US disclosed
EP-3424981-A1 POLYAMIDE RESIN AND FILM COMPRISING SAME UBE Industries, Ltd. (JP) 2019-01-09 EP disclosed
CN-104418822-B Compound with xanthine oxidase inhibitory activity and application thereof 南京华威医药科技开发有限公司 2016-12-28 CN disclosed
CN-102971301-B Antitubercular agents COUNCIL SCIENT IND RES 2015-07-22 CN disclosed
CN-104418822-A Compound with xanthine oxidase inhibition activity, and use thereof NANJING HUAWE MEDICAL TECHNOLOGY DEV CO LTD 2015-03-18 CN disclosed
CN-104039761-A Methods and compositions related to granulocyte colony stimulating factor receptor LIGAND PHARM INC 2014-09-10 CN disclosed
CN-102766100-B Method for preparing polysubstituted benzo[f]quinazoline derivative UNIV TSINGHUA 2014-08-06 CN disclosed
CN-102971301-A 6 - methyl - 4 - phenyl - 5 - ( phenyl or cycloalkyl) carbamoyl - 1,2,3, 4 - tetrahydropyrimidin- 2 - one derivatives as antitubercular agents COUNCIL SCIENT IND RES 2013-03-13 CN disclosed
CN-102766100-A Method for preparing polysubstituted benzo[f]quinazoline derivative UNIV TSINGHUA 2012-11-07 CN disclosed
US-20090221734-A1 RESIN COMPOSITION AND PROCESS FOR THE PRODUCTION THEREOF TEIJIN LIMITED (JP) 2009-09-03 US disclosed
EP-2006332-A1 RESIN COMPOSITION AND METHOD FOR PRODUCING SAME TEIJIN LIMITED (JP) 2008-12-24 EP disclosed
CN-1980901-A Biaryl derivatives BANYU PHARMA CO LTD (JP) 2007-06-13 CN disclosed
CN-1184215-C Substituted oxazole and thiazole derivatives as HPPAR alpha activators GLAXO GROUP LTD (GB) 2005-01-12 CN disclosed
CN-1402716-A Substituted oxazole and thiazole derivatives as HPPAR alpha activators GLAXO GROUP LTD (GB) 2003-03-12 CN disclosed
CN-1216996-A Metallocene cocatalyst DOW CHEMICAL CO (US) 1999-05-19 CN disclosed