SCHEMBL8934960

SCHEMBL8934960

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

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 3/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
ALOX5AP P20292 6/20 0.33
FEN1 P39748 6/20 0.33
AVPR2 P30518 1/20 0.32
AVPR1A P37288 1/20 0.32
SCN9A Q15858 1/20 0.31
PTPN11 Q06124 2/20 0.31
PPARG P37231 1/20 0.31
PLA2G2D Q9UNK4 1/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
HPGD P15428 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL8935043 0.99 GAA (0.35) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8934972 0.99 GAA (0.35) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8935057 0.99 GAA (0.35) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8934979 0.99 GAA (0.35) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8934966 0.99 GAA (0.35) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8935047 0.99 GAA (0.35) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8934975 0.99 GAA (0.35) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8935058 0.99 GAA (0.35) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8935051 0.99 GAA (0.35) FPR2GAAMAPTALOX5APFEN1
SCHEMBL8934964 0.98 GAA (0.34) 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