SCHEMBL8961706

SCHEMBL8961706

C/C=C\CCOc1ccc(-c2ccc(-c3ccc(C4CCC(C5CCC(CCCCC)CC5)CC4)c(F)c3)cc2)c(F)c1F

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 2/20 0.32
SCN9A Q15858 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
SCHEMBL8961501 0.94 FFAR4 (0.33) FFAR4
SCHEMBL8961479 0.93 FFAR4 (0.33) FFAR4
SCHEMBL8961549 0.93 FFAR4 (0.33) FFAR4
SCHEMBL8961470 0.93 FFAR4 (0.33) FFAR4
SCHEMBL8961453 0.93 FFAR4 (0.33) FFAR4
SCHEMBL8961539 0.93 FFAR4 (0.33) FFAR4SCN9A
SCHEMBL8961715 0.92 OPRL1 (0.30) FFAR4
SCHEMBL8963387 0.92 GAA (0.30)
SCHEMBL8934646 0.92 FFAR4 (0.34) FFAR4SCN9A
SCHEMBL8960538 0.92 S1PR1 (0.34) FFAR4SCN9A

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
US-8187494-B2 Four- or five-ring liquid crystal compound having lateral fluorine, liquid crystal composition, and liquid crystal display device JNC CORPORATION (JP) 2012-05-29 US disclosed