SCHEMBL820423

SCHEMBL820423

C=CCC(CC=C)(C(=O)OC1CCCCC1)C(=O)OC1CCCCC1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 2/20 0.40
CYP19A1 P11511 3/20 0.39
CYP2C19 P33261 1/20 0.38
NAAA Q02083 2/20 0.37
HTT P42858 2/20 0.36
CA12 O43570 2/20 0.33
CA1 P00915 2/20 0.33
CA2 P00918 2/20 0.33
CA9 Q16790 2/20 0.33
CCR2 P41597 1/20 0.31
ALDH1A1 P00352 2/20 0.31
GAA P10253 1/20 0.31
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
MMP1 P03956 1/20 0.30
MMP9 P14780 1/20 0.30
MMP12 P39900 1/20 0.30

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
SCHEMBL28564479 0.88 NAAA (0.41) EPHX1CYP19A1CYP2C19NAAAHTT
SCHEMBL28564490 0.86 EPHX1 (0.36) EPHX1CYP19A1CYP2C19NAAAHTT
SCHEMBL28558892 0.84 EPHX1 (0.35) EPHX1CYP19A1CYP2C19NAAAHTT
SCHEMBL28558883 0.83 CYP19A1 (0.43) EPHX1CYP19A1CYP2C19NAAAHTT
SCHEMBL27826766 0.79 EPHX1 (0.35) EPHX1CYP19A1CYP2C19NAAAHTT
SCHEMBL28010185 0.76 CYP19A1 (0.33) EPHX1CYP19A1CYP2C19NAAAHTT
SCHEMBL11183007 0.72 GAA (0.42) GAA
SCHEMBL1593817 0.72 CYP2C19 (0.49) EPHX1CYP19A1CYP2C19NAAAHTT
SCHEMBL17470137 0.72 CYP2C19 (0.49) EPHX1CYP19A1CYP2C19NAAAHTT
SCHEMBL29154403 0.71 EPHX1 (0.40) EPHX1CYP19A1CYP2C19NAAAHTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109678996-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-11-19 CN disclosed
CN-109678998-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-11-19 CN disclosed
CN-109679006-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-08-03 CN disclosed
CN-109679004-B Catalyst component and catalyst system for olefin polymerization, prepolymerized catalyst system and olefin polymerization method 中国石油化工股份有限公司 2021-05-11 CN disclosed
US-8247510-B2 Copolymer and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-08-21 US disclosed
US-20110288250-A1 Copolymer and Production Process Thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-11-24 US disclosed
US-8044159-B2 Homopolymer and copolymer, and production process thereof SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2011-10-25 US disclosed
US-20090171054-A1 HOMOPOLYMER AND COPOLYMER, AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2009-07-02 US disclosed
WO-2007023618-A1 HOMOPOLYMER AND COPOLYMER, AND PRODUCTION PROCESS THEREOF SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-03-01 WO disclosed