SCHEMBL6665099

SCHEMBL6665099

CCCCCc1ccc(C(C)OC(F)(F)c2ccc(C3CCC(CCC)CC3)c(F)c2F)c(F)c1

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 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
SCHEMBL6667103 0.96 ITGB3 (0.30) S1PR1
SCHEMBL6667379 0.94 OPRL1 (0.30)
SCHEMBL6660761 0.93
SCHEMBL6663888 0.87 SPHK1 (0.34)
SCHEMBL6667745 0.86 SPHK1 (0.36) S1PR1
SCHEMBL6665218 0.83 SPHK1 (0.34)
SCHEMBL6665158 0.83 SPHK1 (0.36) S1PR1
SCHEMBL6662926 0.83 SPHK1 (0.40) S1PR1
SCHEMBL6665080 0.82 TRPV1 (0.31)
SCHEMBL6665094 0.81 S1PR1 (0.35) S1PR1

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-0893423-B1 LIQUID CRYSTAL COMPOUNDS HAVING FLUORINATED LINKAGES, LIQUID CRYSTAL COMPOSITIONS, AND LIQUID CRYSTAL DISPLAY DEVICES CHISSO CORP (JP) 2004-09-01 EP disclosed