SCHEMBL8724867

SCHEMBL8724867

[CH]c1ccc(CCC)cc1CCC

nearest known ligand 0.45

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 1/20 0.45
CNR2 P34972 1/20 0.45
ALOX5 P09917 2/20 0.43
CA2 P00918 1/20 0.39
LPL P06858 2/20 0.38
LIPG Q9Y5X9 2/20 0.38
GABRA1 P14867 3/20 0.37
GABRB2 P47870 3/20 0.37
BACE1 P56817 1/20 0.36
FFAR4 Q5NUL3 1/20 0.34
MGLL Q99685 1/20 0.33
PLK1 P53350 1/20 0.33

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
SCHEMBL9740304 0.79 CNR1 (0.50) CNR1CNR2ALOX5CA2LPL
SCHEMBL1263571 0.76 CNR1 (0.47) CNR1CNR2ALOX5CA2LPL
SCHEMBL5048783 0.76 CNR1 (0.47) CNR1CNR2ALOX5CA2LPL
SCHEMBL8729657 0.75 CNR1 (0.35) CNR1CNR2ALOX5LPLLIPG
SCHEMBL7294423 0.74 CNR1 (0.45) CNR1CNR2ALOX5CA2LPL
SCHEMBL7637395 0.74 CNR1 (0.45) CNR1CNR2ALOX5LPLLIPG
SCHEMBL9100129 0.74 CNR1 (0.45) CNR1CNR2ALOX5CA2LPL
SCHEMBL1021086 0.74 ALOX5 (0.71) CNR1CNR2ALOX5GABRA1GABRB2
SCHEMBL18536578 0.74 CNR1 (0.41) CNR1CNR2ALOX5CA2LPL
SCHEMBL10923709 0.73 TRPA1 (0.43) CA2BACE1

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-0609058-B1 Hexahydronaphthalene ester derivatives, their preparation and their therapeutic uses SANKYO CO (JP) 1998-12-09 EP disclosed
US-5491167-A INHIBITORS OF CHOLESTEROL BIOSYNTHESIS SANKYO COMPANY, LIMITED (JP) 1996-02-13 US disclosed
EP-0609058-A2 Hexahydronaphthalene ester derivatives, their preparation and their therapeutic uses SANKYO COMPANY LIMITED (JP) 1994-08-03 EP disclosed