SCHEMBL8958140

SCHEMBL8958140

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

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 16/20 0.37
GABRA1 P14867 2/20 0.35
GABRB2 P47870 2/20 0.35
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
SCHEMBL8958124 0.95 CNR2 (0.34) FPR2GABRA1GABRB2
SCHEMBL8958253 0.94 FPR2 (0.34) FPR2GABRA1GABRB2
SCHEMBL8958241 0.93 FPR2 (0.34) FPR2GABRA1GABRB2
SCHEMBL8958575 0.93 FPR2 (0.34) FPR2GABRA1GABRB2
SCHEMBL8958278 0.93 FPR2 (0.34) FPR2GABRA1GABRB2
SCHEMBL8958251 0.93 FPR2 (0.34) FPR2GABRA1GABRB2
SCHEMBL8958096 0.93 FPR2 (0.36) FPR2
SCHEMBL8958732 0.92 FPR2 (0.33) FPR2GABRA1GABRB2
SCHEMBL8956305 0.92 FPR2 (0.35) FPR2GABRA1GABRB2HTR2CHTR2B
SCHEMBL8956816 0.90 FPR2 (0.40) FPR2HTR2CHTR2BHTR2A

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