SCHEMBL8961363

SCHEMBL8961363

C/C=C/C1CCC(C2CCC(c3ccc(-c4ccc(-c5ccc(OCCC)c(F)c5F)cc4)cc3F)CC2)CC1

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 1/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
FFAR4 Q5NUL3 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
SCHEMBL8934423 0.97 FPR2 (0.33) FPR2GABRA1GABRB2FFAR4
SCHEMBL8961357 0.95 SCN9A (0.33)
SCHEMBL8961461 0.95 FPR2 (0.31) FPR2
SCHEMBL8961414 0.94 PTPN11 (0.32) FPR2
SCHEMBL8961349 0.94 PTPN11 (0.32) FPR2
SCHEMBL8961297 0.94 PTPN11 (0.32) FPR2
SCHEMBL8961435 0.94 PTPN11 (0.32) FPR2
SCHEMBL8961433 0.93 NAAA (0.32) FPR2FFAR4
SCHEMBL8934445 0.93 RARB (0.34) FFAR4
SCHEMBL8934436 0.92 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