SCHEMBL6667694

SCHEMBL6667694

CCCCC[C@H]1CC[C@H](c2ccc(C(F)(F)OCCc3ccc(CCC)c(F)c3)c(F)c2F)CC1

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
S1PR1 P21453 1/20 0.32

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
SCHEMBL6660759 0.96 S1PR1 (0.32) S1PR1
SCHEMBL6667669 0.96 S1PR1 (0.34) S1PR1
SCHEMBL6667097 0.94 S1PR1 (0.35) S1PR1
SCHEMBL6665322 0.94 OPRL1 (0.31)
SCHEMBL6665075 0.93 S1PR1 (0.34) S1PR1
SCHEMBL6665094 0.91 S1PR1 (0.35) S1PR1
SCHEMBL6667374 0.90 OPRL1 (0.31)
SCHEMBL6660750 0.90 HRH3 (0.32)
SCHEMBL6663374 0.89 GAA (0.30)
SCHEMBL6665213 0.88 SPHK1 (0.36)

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