SCHEMBL8935246

SCHEMBL8935246

C/C=C/C1CCC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.32

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.32
ALOX5AP P20292 3/20 0.32
FEN1 P39748 3/20 0.32
FPR2 P25090 2/20 0.32
CNR2 P34972 2/20 0.30
CNR1 P21554 1/20 0.30
CHRM2 P08172 1/20 0.30
CHRM4 P08173 1/20 0.30
CHRM5 P08912 1/20 0.30
CHRM1 P11229 1/20 0.30
CHRM3 P20309 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
SCHEMBL8962599 0.97 SCN9A (0.31) SCN9AALOX5APFEN1FPR2
SCHEMBL8935245 0.97 FPR2 (0.33) SCN9AALOX5APFEN1FPR2CNR2
SCHEMBL8935300 0.96 FPR2 (0.32) ALOX5APFEN1FPR2
SCHEMBL8935320 0.96 FPR2 (0.32) ALOX5APFEN1FPR2
SCHEMBL8935312 0.96 FPR2 (0.32) ALOX5APFEN1FPR2
SCHEMBL8935333 0.96 FPR2 (0.32) ALOX5APFEN1FPR2
SCHEMBL8935230 0.95 FPR2 (0.36) ALOX5APFEN1FPR2
SCHEMBL19985540 0.95 SCN9A (0.34) SCN9AALOX5APFEN1FPR2
SCHEMBL8962607 0.94 FPR2 (0.32) ALOX5APFEN1FPR2
SCHEMBL8962778 0.93 FPR2 (0.31) FPR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2206695-B1 TETRA- OR PENTA-CYCLIC LIQUID CRYSTALLINE COMPOUND HAVING LATERAL FLUORINE, LIQUID CRYSTAL COMPOSITION, AND LIQUID CRYSTAL DISPLAY ELEMENT JNC CORP (JP) 2013-09-18 EP disclosed
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