SCHEMBL5086548

SCHEMBL5086548

CCCCCc1cc(CCCCC)c(OC)c([Si](C)(C)Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 7/20 0.41
ALOX5 P09917 8/20 0.38
CYP3A4 P08684 1/20 0.38
TLR8 Q9NR97 1/20 0.36
CNR1 P21554 1/20 0.35
CNR2 P34972 1/20 0.35
GPR18 Q14330 1/20 0.35
GPR55 Q9Y2T6 1/20 0.35
HTR2A P28223 1/20 0.35

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
SCHEMBL5085742 0.81 CNR1 (0.36) PTGS2CYP3A4TLR8CNR1CNR2
SCHEMBL20226039 0.81 PTGS2 (0.44) PTGS2ALOX5CYP3A4HTR2A
SCHEMBL5086436 0.77 PTGS2 (0.35) PTGS2ALOX5CYP3A4TLR8CNR1
SCHEMBL5089891 0.75 PTGS2 (0.45) PTGS2ALOX5CYP3A4
SCHEMBL5087085 0.75 PTGS2 (0.33) PTGS2ALOX5CYP3A4TLR8
SCHEMBL5090641 0.75 CNR1 (0.38) PTGS2ALOX5CNR1CNR2GPR55
SCHEMBL5086429 0.75 PTGS2 (0.33) PTGS2ALOX5CYP3A4TLR8CNR1
SCHEMBL5087086 0.75 PTGS2 (0.33) PTGS2ALOX5CNR1CNR2GPR55
SCHEMBL27452688 0.73 ALOX5 (0.38) PTGS2ALOX5CYP3A4
SCHEMBL5089839 0.73 PTGS2 (0.34) PTGS2ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1498178-B1 Transition metal complex and process for producing the same SUMITOMO CHEMICAL CO (JP) 2008-06-11 EP disclosed
EP-1498178-A2 Transition metal complex, process for producing the same, olefin polymerization catalyst containing the transition metal complex and process for producing olefin polymers Sumitomo Chemical Company, Limited (JP) 2005-01-19 EP disclosed
EP-0963990-B1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed
EP-0842939-B1 OLEFIN POLYMERIZATION CATALYST CONTAINING A TRANSITION METAL COMPLEX AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL CO (JP) 2004-10-06 EP disclosed
US-6329478-B1 SOLUBILITY IN SATURATED HYDROCARBON SOLVENTS SUMITMO CHEMICAL COMPANY, LIMITED 2001-12-11 US disclosed
US-6197990-B1 REACTING CYCLOPENTADIENE AND METAL HYDRIDE IN PRESENCE OF AMINE COMPOUND SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2001-03-06 US disclosed
EP-0963990-A1 PROCESS FOR PRODUCING CYCLOPENTADIENYL METAL SALTS AND PROCESS FOR PRODUCING CYCLOPENTADIENE DERIVATIVES BY UTILIZING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1999-12-15 EP disclosed
EP-0842939-A1 TRANSITION METAL COMPLEX, PROCESS FOR THE PREPARATION THEREOF, POLYMERIZATION CATALYST FOR OLEFINS CONTAINING THE COMPLEX, AND PROCESS FOR PRODUCING OLEFIN POLYMERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1998-05-20 EP disclosed