SCHEMBL2923253

SCHEMBL2923253

c1cc(-c2ccc(Oc3ccc(Oc4ccc(-c5ccc(OCCCCC6CO6)cc5)cc4)nc3)cc2)ccc1OCCCCC1CO1

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ACACB O00763 11/20 0.39
ACACA Q13085 7/20 0.39
LTA4H P09960 6/20 0.35
KCNH2 Q12809 2/20 0.35
CYP19A1 P11511 1/20 0.34
CYP2C9 P11712 1/20 0.34
CYP2C19 P33261 1/20 0.34

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
SCHEMBL2903528 0.88 MEN1 (0.37) ACACBACACALTA4HCYP19A1CYP2C9
SCHEMBL2899269 0.85 LTA4H (0.36) LTA4HKCNH2CYP19A1CYP2C9CYP2C19
SCHEMBL5633969 0.84 TDP1 (0.49) ACACBACACALTA4H
SCHEMBL5687943 0.84 LTA4H (0.50) LTA4HKCNH2CYP19A1CYP2C9CYP2C19
SCHEMBL2833284 0.83 HRH3 (0.44) KCNH2
SCHEMBL2718081 0.83 HRH3 (0.44) KCNH2
SCHEMBL2906493 0.83 HRH3 (0.37) LTA4HKCNH2CYP2C9CYP2C19
SCHEMBL2905143 0.83 HDAC3 (0.39) LTA4HKCNH2
SCHEMBL2898859 0.82 LTA4H (0.36) LTA4HCYP19A1CYP2C9CYP2C19
SCHEMBL2720901 0.82 HRH3 (0.42) KCNH2

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
EP-1636209-B1 EPOXY COMPOUND AND CURED EPOXY RESIN PRODUCT SUMITOMO CHEMICAL CO (JP) 2010-08-11 EP disclosed
US-7279574-B2 Epoxy compound and cured epoxy resin product SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2007-10-09 US disclosed
US-20060159929-A1 Epoxy compound and cured epoxy resin product HITACHI, LTD. (JP) 2006-07-20 US disclosed