SCHEMBL14922666

SCHEMBL14922666

CCCCOc1ccc(C2CCC(COC3CCC(c4ccc(-c5ccc(OCC)c(F)c5F)c(F)c4F)CC3)CC2)c(F)c1F

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALOX5AP P20292 4/20 0.35
FEN1 P39748 4/20 0.35
SCN9A Q15858 1/20 0.35
GPR119 Q8TDV5 6/20 0.34
HCRTR2 O43614 3/20 0.33
FPR2 P25090 2/20 0.33
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
PPARD Q03181 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
PTGDR2 Q9Y5Y4 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
SCHEMBL14922577 1.00 ALOX5AP (0.35) ALOX5APFEN1SCN9AGPR119HCRTR2
SCHEMBL14922568 0.98 FEN1 (0.36) ALOX5APFEN1SCN9AGPR119HCRTR2
SCHEMBL14922582 0.98 FEN1 (0.36) ALOX5APFEN1SCN9AGPR119HCRTR2
SCHEMBL14922576 0.94 ALOX5AP (0.35) ALOX5APFEN1GPR119HCRTR2FPR2
SCHEMBL14922665 0.94 ALOX5AP (0.35) ALOX5APFEN1GPR119HCRTR2FPR2
SCHEMBL14922638 0.93 GPR119 (0.37) ALOX5APFEN1GPR119HCRTR2FPR2
SCHEMBL14922575 0.93 GPR119 (0.37) ALOX5APFEN1GPR119HCRTR2FPR2
SCHEMBL12197116 0.93 GPR119 (0.34) ALOX5APFEN1SCN9AGPR119HCRTR2
SCHEMBL12197003 0.93 GPR119 (0.34) ALOX5APFEN1SCN9AGPR119HCRTR2
SCHEMBL14922618 0.92 GPR119 (0.36) ALOX5APFEN1SCN9AGPR119HCRTR2

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-8435422-B2 Five-ring compound, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-05-07 US disclosed