SCHEMBL8944548

SCHEMBL8944548

C=CCCC1CCC(c2ccc(-c3ccc(-c4ccc(OCCC)c(F)c4F)cc3)c(F)c2)CO1

nearest known ligand 0.35

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 10/20 0.35
GABRA1 P14867 1/20 0.35
GABRB2 P47870 1/20 0.35
ALOX5 P09917 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
SCHEMBL8944693 0.96 CNR2 (0.32) FPR2GABRA1GABRB2
SCHEMBL8944866 0.95 FPR2 (0.33) FPR2GABRA1GABRB2
SCHEMBL8944704 0.94 FPR2 (0.33) FPR2GABRA1GABRB2
SCHEMBL8944613 0.94 FPR2 (0.33) FPR2GABRA1GABRB2
SCHEMBL8944887 0.94 FPR2 (0.33) FPR2GABRA1GABRB2
SCHEMBL8944718 0.94 FPR2 (0.33) FPR2GABRA1GABRB2
SCHEMBL8944732 0.94 FPR2 (0.34) FPR2ALOX5
SCHEMBL13579246 0.94 GABRA1 (0.36) FPR2GABRA1GABRB2ALOX5
SCHEMBL13579457 0.93 GABRA1 (0.35) FPR2GABRA1GABRB2ALOX5
SCHEMBL13579337 0.93 GABRA1 (0.35) FPR2GABRA1GABRB2ALOX5

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