SCHEMBL8958124

SCHEMBL8958124

C=CCCC1OCC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)c(F)c2F)CO1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.34
FPR2 P25090 6/20 0.33
CNR1 P21554 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRB2 P47870 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
SCHEMBL8958253 0.97 FPR2 (0.34) CNR2FPR2CNR1GABRA1GABRB2
SCHEMBL8958278 0.96 FPR2 (0.34) CNR2FPR2CNR1GABRA1GABRB2
SCHEMBL8958575 0.96 FPR2 (0.34) CNR2FPR2CNR1GABRA1GABRB2
SCHEMBL8958241 0.96 FPR2 (0.34) CNR2FPR2CNR1GABRA1GABRB2
SCHEMBL8958251 0.96 FPR2 (0.34) CNR2FPR2CNR1GABRA1GABRB2
SCHEMBL8958140 0.95 FPR2 (0.37) FPR2GABRA1GABRB2
SCHEMBL8958742 0.93 FPR2 (0.32) CNR2FPR2
SCHEMBL8958096 0.92 FPR2 (0.36) FPR2
SCHEMBL8956389 0.92 CNR2 (0.33) CNR2FPR2CNR1GABRA1GABRB2
SCHEMBL8958732 0.91 FPR2 (0.33) FPR2GABRA1GABRB2

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