SCHEMBL495539

SCHEMBL495539

CCC(CCCCCCCCCCCCCCC(=O)OCC(C)C)CCC(=O)OCC(C)C

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 1/20 0.61
TSHR P16473 1/20 0.61
ATM Q13315 1/20 0.61
TDP1 Q9NUW8 1/20 0.61
MAPT P10636 1/20 0.50
LMNA P02545 2/20 0.49
ALDH1A1 P00352 1/20 0.49
KDM4E B2RXH2 1/20 0.44
DUSP3 P51452 1/20 0.44
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
PRKCA P17252 1/20 0.42
PRKCE Q02156 1/20 0.42
PRKCQ Q04759 1/20 0.42
PRKCD Q05655 1/20 0.42
DGKA P23743 2/20 0.41
EPHX2 P34913 1/20 0.41
CA2 P00918 1/20 0.41
LPAR1 Q92633 2/20 0.40
LPAR3 Q9UBY5 2/20 0.40

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
SCHEMBL494023 1.00 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL494165 1.00 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL494496 1.00 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL495916 1.00 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL494389 1.00 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL493964 1.00 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL496102 1.00 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL495240 1.00 CYP3A4 (0.61) CYP3A4TSHRATMTDP1MAPT
SCHEMBL14809587 0.92 CYP3A4 (0.60) CYP3A4TSHRATMTDP1MAPT
SCHEMBL494416 0.89 CYP3A4 (0.59) CYP3A4TSHRATMTDP1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130072648-A1 SOLID CATALYST FOR OLEFIN POLYMERIZATION AND PROCESS FOR PRODUCING OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2013-03-21 US disclosed
US-8105970-B2 Olefin polymerization catalyst component and production process thereof, and production proces of olefin polymerization catalyst and olefin polymer SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-01-31 US disclosed
US-20110245439-A1 OLEFIN POLYMERIZATION CATALYST COMPONENT AND PRODUCTION PROCESS THEREOF, AND PRODUCTION PROCES OF OLEFIN POLYMERIZATION CATALYST AND OLEFIN POLYMER SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-06 US disclosed