SCHEMBL3971742

SCHEMBL3971742

Oc1ccc(C2(c3ccc(O)cc3-c3ccc4ccccc4c3)C3CC4CC(C3)CC2C4)c(-c2ccc3ccccc3c2)c1

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ESR2 Q92731 11/20 0.44
ESR1 P03372 10/20 0.44
HSD17B1 P14061 2/20 0.42
HSD17B2 P37059 2/20 0.42
MIF P14174 1/20 0.41
CYP1A2 P05177 2/20 0.41
HDAC4 P56524 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
GSTP1 P09211 1/20 0.37
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2B6 P20813 1/20 0.36
CYP2C19 P33261 1/20 0.36
ALOX5 P09917 1/20 0.36
ALOX5AP P20292 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
SCHEMBL3976012 0.81 ESR2 (0.43) ESR2ESR1HSD17B1HSD17B2MIF
SCHEMBL25879053 0.75 CYP2A6 (0.37) ESR2ESR1GSTP1CYP3A4ALOX5
SCHEMBL4892810 0.75 ESR2 (0.54) ESR2ESR1HSD17B1HSD17B2MIF
SCHEMBL25038168 0.74 MEN1 (0.36) CYP1A2GSTP1
SCHEMBL25451924 0.73 ESR1 (0.33) ESR2ESR1GSTP1
SCHEMBL23614997 0.73 ESR1 (0.33) ESR2ESR1GSTP1
SCHEMBL23614158 0.72 ESR1 (0.32) ESR2ESR1
SCHEMBL23621021 0.72 ESR1 (0.32) ESR2ESR1
SCHEMBL23614588 0.72 ESR1 (0.32) ESR2ESR1HSD17B1HSD17B2
SCHEMBL2004974 0.72 CYP1A2 (0.39) ESR2ESR1HSD17B1HSD17B2CYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1469026-B1 AROMATIC POLYCARBONATE RESIN PROCESS FOR PRODUCING THE SAME OPTICAL PART MOLDING MATERIAL AND OPTICAL PART IDEMITSU KOSAN CO (JP) 2009-05-06 EP disclosed
US-7329718-B2 Aromatic polycarbonate resin, process for producing the same, optical-part molding material, and optical part IDEMITSU KOSAN CO., LTD. (JP) 2008-02-12 US disclosed
US-20060270823-A1 Suited to a molding material for an optical disc substrate such as a digital audio disc, a digital video disc and an optical memory disc, various lenses such as a lens for an optical pickup, spectacle lenses, contact lenses and a lens sheet, an optical sheet substrate IDEMITSU KOSAN CO., LTD (JP) 2006-11-30 US disclosed
US-7112644-B2 Aromatic polycarbonate resin, process for producing the same, optical-part molding material, and optical part IDEMITSU KOSAN CO., LTD. (JP) 2006-09-26 US disclosed
US-20050143553-A1 Aromatic polycarbonate resin, process for producing the same, optical-part molding material, and optical part IDEMITSU KOSAN CO., LTD (JP) 2005-06-30 US disclosed
EP-1469026-A1 AROMATIC POLYCARBONATE RESIN PROCESS FOR PRODUCING THE SAME OPTICAL PART MOLDINGMATERIAL AND OPTICAL PART IDEMITSU KOSAN CO., LTD. (JP) 2004-10-20 EP disclosed