SCHEMBL14766167

SCHEMBL14766167

C=CCCOc1ccc(-c2ccc(CCc3ccc(-c4ccc(OCC)cc4)c(F)c3F)cc2)c(F)c1F

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.36
FFAR4 Q5NUL3 5/20 0.35
FFAR1 O14842 4/20 0.35
CNR1 P21554 1/20 0.34
GABRA1 P14867 4/20 0.34
GABRB2 P47870 4/20 0.34
CTSL P07711 1/20 0.33
CTSS P25774 1/20 0.33
CTSK P43235 1/20 0.33
L3MBTL1 Q9Y468 2/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2D6 P10635 1/20 0.32
CYP2C19 P33261 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
RET P07949 1/20 0.31
MAPT P10636 1/20 0.31
RAB9A P51151 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
SCHEMBL14766597 1.00 CNR2 (0.36) CNR2FFAR4FFAR1CNR1GABRA1
SCHEMBL14766470 0.94 CNR2 (0.42) CNR2CNR1GABRA1GABRB2CTSL
SCHEMBL14766286 0.94 CNR2 (0.42) CNR2CNR1GABRA1GABRB2CTSL
SCHEMBL14765977 0.92 S1PR1 (0.38) CNR2FFAR4FFAR1CNR1GABRA1
SCHEMBL14766600 0.91 CNR2 (0.43) CNR2CNR1GABRA1GABRB2CTSL
SCHEMBL14766295 0.91 CNR2 (0.43) CNR2CNR1GABRA1GABRB2CTSL
SCHEMBL14767237 0.89 CTSL (0.38) CNR2FFAR4FFAR1GABRA1GABRB2
SCHEMBL12740118 0.89 FFAR4 (0.35) CNR2FFAR4FFAR1CNR1GABRA1
SCHEMBL14766411 0.89 CTSL (0.38) CNR2FFAR4FFAR1GABRA1GABRB2
SCHEMBL12735599 0.89 FFAR4 (0.35) CNR2FFAR4FFAR1CNR1GABRA1

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-8394294-B2 Four-ring liquid crystal compound having lateral fluorine, liquid crystal composition and liquid crystal display device JNC CORPORATION (JP) 2013-03-12 US disclosed