SCHEMBL8935040

SCHEMBL8935040

CCCCCCCC1CCC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)c(F)c2F)CC1

nearest known ligand 0.35

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.35
MAPT P10636 1/20 0.35
SCN9A Q15858 1/20 0.33
ALOX5AP P20292 5/20 0.32
FEN1 P39748 5/20 0.32
FPR2 P25090 3/20 0.32
PTPN11 Q06124 3/20 0.31
HTR2C P28335 2/20 0.31
PPARG P37231 1/20 0.31
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
PLA2G2D Q9UNK4 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
SCHEMBL8934964 0.99 GAA (0.34) GAAMAPTSCN9AALOX5APFEN1
SCHEMBL8934975 0.98 GAA (0.35) GAAMAPTSCN9AALOX5APFEN1
SCHEMBL8934979 0.98 GAA (0.35) GAAMAPTSCN9AALOX5APFEN1
SCHEMBL8935057 0.98 GAA (0.35) GAAMAPTSCN9AALOX5APFEN1
SCHEMBL8935047 0.98 GAA (0.35) GAAMAPTSCN9AALOX5APFEN1
SCHEMBL8934966 0.98 GAA (0.35) GAAMAPTSCN9AALOX5APFEN1
SCHEMBL8935051 0.98 GAA (0.35) GAAMAPTSCN9AALOX5APFEN1
SCHEMBL8934972 0.98 GAA (0.35) GAAMAPTSCN9AALOX5APFEN1
SCHEMBL8935058 0.98 GAA (0.35) GAAMAPTSCN9AALOX5APFEN1
SCHEMBL8935043 0.98 GAA (0.35) GAAMAPTSCN9AALOX5APFEN1

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