SCHEMBL2156113

SCHEMBL2156113

CC(C)(C)c1cccc2c1C(=O)NC2=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.47
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
HPGD P15428 1/20 0.47
HSD17B10 Q99714 1/20 0.47
GSK3B P49841 1/20 0.46
PARP1 P09874 5/20 0.44
CASP3 P42574 3/20 0.41
CASP7 P55210 2/20 0.41
CASP2 P42575 1/20 0.41
CASP6 P55212 1/20 0.41
CASP8 Q14790 1/20 0.41
CES1 P23141 1/20 0.40
TNKS O95271 1/20 0.39
TNKS2 Q9H2K2 1/20 0.39
PARP3 Q9Y6F1 1/20 0.39
CA2 P00918 1/20 0.39
POLB P06746 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37

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
Bicarbonate SCHEMBL23581765 0.93 KDM4E (0.50) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL29212759 0.87 KDM4E (0.49) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL8827920 0.85 KDM4E (0.45) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL9510827 0.81 GSK3B (0.44) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL30360556 0.81 CES1 (0.56) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL5285230 0.78 PARP1 (0.41) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL7130298 0.78 CES1 (0.45) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL869660 0.77 KDM4E (0.39) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL16754925 0.77 GSK3B (0.62) KDM4EALDH1A1GAAHPGDHSD17B10
SCHEMBL1860679 0.76 PARP1 (0.40) KDM4EALDH1A1GAAHPGDHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107790189-B Catalyst for fatty acid methyl ester ethoxylation 中国石油化工股份有限公司 2020-06-09 CN claimed
CN-107790189-B Catalyst for fatty acid methyl ester ethoxylation 中国石油化工股份有限公司 2020-06-09 CN disclosed
US-9284296-B2 Bipyridine sulfonamide derivatives for the treatment of neurodegenerative diseases or conditions AUBERGINE PHARMACEUTICALS LLC (US) 2016-03-15 US disclosed
US-8399109-B2 Organic electronic devices using phthalimide compounds THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2013-03-19 US disclosed
US-20130025684-A1 ORGANIC ELECTRONIC DEVICES USING PHTHALIMIDE COMPOUNDS ENERGY, UNITED STATES DEPARTMENT OF 2013-01-31 US disclosed
EP-2378586-B1 Organic electronic devices using phthalimide compounds UNIV SOUTHERN CALIFORNIA (US) 2012-11-21 EP disclosed
US-8293385-B2 Organic electronic devices using phthalimide compounds THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2012-10-23 US disclosed
EP-2378586-A1 Organic electronic devices using phthalimide compounds The University of Southern California (US) 2011-10-19 EP disclosed
EP-2005500-B1 ORGANIC ELECTRONIC DEVICES USING PHTHALIMIDE COMPOUNDS UNIV SOUTHERN CALIFORNIA (US) 2011-07-06 EP disclosed
US-20100300538-A1 ORGANIC ELECTRONIC DEVICES USING PHTHALIMIDE COMPOUNDS ENERGY, UNITED STATES DEPARTMENT OF 2010-12-02 US disclosed
US-7790298-B2 Organic electronic devices using phthalimide compounds THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2010-09-07 US disclosed
US-20090107551-A1 Organic electronic devices using phthalimide compounds ENERGY, U.S. DEPARTMENT OF 2009-04-30 US disclosed
EP-2005500-A1 ORGANIC ELECTRONIC DEVICES USING PHTHALIMIDE COMPOUNDS The University Of Southern California (US) 2008-12-24 EP disclosed
WO-2007120788-A1 ORGANIC ELECTRONIC DEVICES USING PHTHALIMIDE COMPOUNDS THE UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2007-10-25 WO disclosed
US-4556651-A Secalonic acid derivatives as antitumor agents ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1985-12-03 US disclosed
EP-0064199-B1 NOVEL SECALONIC ACID DERIVATIVES AND METHOD FOR PREPARING THEREOF Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1985-08-21 EP disclosed
US-4418061-A ANTITUMOR AGENTS ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1983-11-29 US disclosed
EP-0064199-A1 Novel secalonic acid derivatives and method for preparing thereof Asahi Kasei Kogyo Kabushiki Kaisha (JP) 1982-11-10 EP disclosed