SCHEMBL5086429

SCHEMBL5086429

CCCCCc1cc(CCCCC)c(OC)c([Si](C)(C)C2=C(C)C(C)=C(C)C2C)c1

nearest known ligand 0.33

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PTGS2 P35354 2/20 0.33
ALOX5 P09917 7/20 0.32
FUT7 Q11130 1/20 0.32
HTR2A P28223 1/20 0.31
MEN1 O00255 1/20 0.31
MAPT P10636 1/20 0.31
MAPK1 P28482 1/20 0.31
HTT P42858 1/20 0.31
RAD52 P43351 1/20 0.31
KMT2A Q03164 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
TLR8 Q9NR97 1/20 0.30
GPR55 Q9Y2T6 2/20 0.30
PPARG P37231 1/20 0.30
PPARA Q07869 1/20 0.30
CNR1 P21554 1/20 0.30
CNR2 P34972 1/20 0.30
CYP3A4 P08684 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
SCHEMBL3672934 0.88 PTGS2 (0.33) PTGS2ALOX5FUT7HTR2AMEN1
SCHEMBL5089995 0.85 CNR1 (0.33) MEN1MAPTMAPK1HTTRAD52
SCHEMBL10318885 0.75 PTGS2 (0.38) PTGS2FUT7HTR2AMAPTCYP3A4
SCHEMBL5086548 0.75 PTGS2 (0.41) PTGS2ALOX5HTR2ATLR8GPR55
SCHEMBL5087086 0.73 PTGS2 (0.33) PTGS2ALOX5GPR55CNR1CNR2
SCHEMBL5087103 0.72 ACHE (0.31)
SCHEMBL5086436 0.72 PTGS2 (0.35) PTGS2ALOX5TLR8CNR1CNR2
SCHEMBL7984096 0.72 PTGS2 (0.32) PTGS2
SCHEMBL5087085 0.70 PTGS2 (0.33) PTGS2ALOX5TLR8CYP3A4
SCHEMBL5086977 0.70 ACHE (0.31)

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