SCHEMBL8942733

SCHEMBL8942733

C/C=C/C1CCC(c2ccc(-c3ccc(-c4ccc(OCCC)c(F)c4F)cc3)c(F)c2F)OC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 4/20 0.33
GABRA1 P14867 1/20 0.33
GABRB2 P47870 1/20 0.33
HTR2C P28335 2/20 0.31
HTR2B P41595 2/20 0.31
HTR2A P28223 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
SCHEMBL8942735 0.95 CNR2 (0.30)
SCHEMBL8943173 0.94 FPR2 (0.31) FPR2GABRA1GABRB2
SCHEMBL8942721 0.94 FPR2 (0.32) FPR2
SCHEMBL8943086 0.93 FPR2 (0.30) FPR2
SCHEMBL8942926 0.93 FPR2 (0.30) FPR2
SCHEMBL8942745 0.93 FPR2 (0.30) FPR2
SCHEMBL8942793 0.93 FPR2 (0.30) FPR2
SCHEMBL8941474 0.92 FPR2 (0.33) FPR2GABRA1GABRB2HTR2CHTR2B
SCHEMBL18719127 0.92 FPR2 (0.35) FPR2GABRA1GABRB2HTR2CHTR2B
SCHEMBL18718338 0.92 FPR2 (0.35) FPR2GABRA1GABRB2HTR2CHTR2B

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