SCHEMBL8767813

SCHEMBL8767813

Fc1cc(C2CCC(CC[C@H]3CC[C@H](C4CCCC4)CC3)CC2)cc(F)c1F

nearest known ligand 0.37

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 13/20 0.37
ALOX5 P09917 1/20 0.36
ESR2 Q92731 2/20 0.33
DPP4 P27487 1/20 0.31

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
SCHEMBL8767819 1.00 OPRL1 (0.37) OPRL1ALOX5ESR2DPP4
SCHEMBL8767808 1.00 OPRL1 (0.37) OPRL1ALOX5ESR2DPP4
SCHEMBL8767218 0.97 OPRL1 (0.37) OPRL1ALOX5ESR2
SCHEMBL21581477 0.95 ESR2 (0.36) OPRL1ESR2
SCHEMBL8768409 0.91 OPRL1 (0.39) OPRL1ESR2DPP4
SCHEMBL8768400 0.91 OPRL1 (0.39) OPRL1ESR2DPP4
SCHEMBL8768502 0.90 SIGMAR1 (0.37) OPRL1ALOX5ESR2
SCHEMBL8767048 0.90 OPRL1 (0.35) OPRL1ALOX5ESR2
SCHEMBL19720364 0.90 OPRL1 (0.40) OPRL1ESR2DPP4
SCHEMBL8767030 0.89 ALDH1A1 (0.33) ALOX5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0789067-A1 Cyclopentyl derivatives useful as liquid crystals Rolic AG (CH) 1997-08-13 EP disclosed