SCHEMBL8961966

SCHEMBL8961966

CCCCCOc1ccc(-c2ccc(-c3ccc(C4CCC(C5CCC(CCCCC)CC5)CC4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.33

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.33
GAA P10253 1/20 0.32
MAPT P10636 1/20 0.32
ALOX5AP P20292 4/20 0.31
FEN1 P39748 4/20 0.31
AVPR2 P30518 1/20 0.31
AVPR1A P37288 1/20 0.31
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
SCHEMBL8962215 0.99 GAA (0.34) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8962014 0.99 GAA (0.34) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8962202 0.99 GAA (0.34) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8962197 0.99 GAA (0.34) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8962255 0.99 GAA (0.34) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8962008 0.99 GAA (0.34) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8962009 0.99 GAA (0.34) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8961973 0.99 GAA (0.34) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8962239 0.99 GAA (0.34) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8962013 0.98 GAA (0.32) FPR2GAAMAPTALOX5APFEN1

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