SCHEMBL667372

SCHEMBL667372

CCC(C(=O)OC)c1cccs1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HPGD P15428 3/20 0.41
ALOX5 P09917 1/20 0.41
ALDH1A1 P00352 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
CES2 O00748 1/20 0.40
CES1 P23141 1/20 0.40
KEAP1 Q14145 1/20 0.40
KDM4E B2RXH2 3/20 0.40
TACR3 P29371 1/20 0.39
GLS O94925 1/20 0.39
TSHR P16473 3/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2D6 P10635 1/20 0.38
CYP2C9 P11712 1/20 0.38
ALOX15 P16050 1/20 0.38
CYP2C19 P33261 1/20 0.38
LRRK2 Q5S007 1/20 0.38
GAA P10253 1/20 0.38
MAPT P10636 2/20 0.38
MAPK1 P28482 1/20 0.38

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
SCHEMBL30174080 1.00 HPGD (0.41) HPGDALOX5ALDH1A1L3MBTL1CES2
SCHEMBL25358790 0.87 MME (0.43) HPGDALOX5ALDH1A1CES2CES1
SCHEMBL29636408 0.83 HPGD (0.39) HPGDALOX5ALDH1A1L3MBTL1CES2
SCHEMBL9000645 0.82 ZDHHC7 (0.45) L3MBTL1TSHR
SCHEMBL29198054 0.81 CYP2C19 (0.41) HPGDALOX5ALDH1A1CES2CES1
SCHEMBL6712871 0.81 ESR1 (0.47) HPGDALDH1A1TSHRCYP3A4CYP2D6
SCHEMBL2071309 0.81 CYP2C19 (0.46) HPGDALOX5ALDH1A1L3MBTL1CES2
SCHEMBL10210730 0.79 ALOX5 (0.50) HPGDALOX5ALDH1A1CES2CES1
SCHEMBL6464486 0.79 ALOX5 (0.50) HPGDALOX5ALDH1A1CES2CES1
SCHEMBL27347276 0.79 ALOX5 (0.42) HPGDALOX5ALDH1A1L3MBTL1CES2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2455992-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND HIGH-MOLECULAR LIGHT-EMITTING COMPOSITION Sumitomo Chemical Company, Limited (JP) 2012-05-23 EP claimed
US-20120112627-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND LIGHT EMITTING POLYMER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-10 US claimed
CN-110462864-B Solvent system for preparing photosensitive organic electronic device 住友化学株式会社 2024-03-15 CN disclosed
CN-116670139-A Compounds of formula (I) 住友化学株式会社 2023-08-29 CN disclosed
CN-116348521-A Polymer 住友化学株式会社 2023-06-27 CN disclosed
CN-106029665-A New cyclazines and their use as semiconductors 巴斯夫欧洲公司 2016-10-12 CN disclosed
US-8945807-B2 Blends of fullerene derivatives, and uses thereof in electronic devices SOLENNE BV (NL) 2015-02-03 US disclosed
EP-2043952-B1 BLENDS OF FULLERENE DERIVATIVES AND USES THEREOF IN ELECTRONIC DEVICES SOLENNE B V I O (NL) 2014-10-29 EP disclosed
US-20130306944-A1 Blends of Fullerene Derivatives, and Uses Thereof in Electronic Devices SOLENNE BV (NL) 2013-11-21 US disclosed
US-8435713-B2 Blends of fullerene derivatives, and uses thereof in electronic devices SOLENNE BV (NL) 2013-05-07 US disclosed
EP-2455992-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND HIGH-MOLECULAR LIGHT-EMITTING COMPOSITION Sumitomo Chemical Company, Limited (JP) 2012-05-23 EP disclosed
US-20120112627-A1 ORGANIC ELECTROLUMINESCENT ELEMENT AND LIGHT EMITTING POLYMER COMPOSITION SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-05-10 US disclosed
US-20120043507-A1 BLENDS OF FULLERENE DERIVATIVES, AND USES THEREOF IN ELECTRONIC DEVICES SOLENNE BV (NL) 2012-02-23 US disclosed
US-20100127244-A1 Blends of Fullerene Derivatives, and Uses Thereof in Electronic Devices SOLENNE BV (NL) 2010-05-27 US disclosed
EP-2043952-A2 BLENDS OF FULLERENE DERIVATIVES, AND USES THEREOF IN ELECTRONIC DEVICES Solenne B.V. i.o. (NL) 2009-04-08 EP disclosed
WO-2008006071-A2 BLENDS OF FULLERENE DERIVATIVES, AND USES THEREOF IN ELECTRONIC DEVICES SOLENNE BV (NL) 2008-01-10 WO disclosed