SCHEMBL8944239

SCHEMBL8944239

C/C=C/C1CCC(c2ccc(-c3ccc(-c4ccc(OCCCCC)c(F)c4F)cc3)c(F)c2)CO1

nearest known ligand 0.34

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FPR2 P25090 4/20 0.34
GABRA1 P14867 1/20 0.30
GABRB2 P47870 1/20 0.30
PPARD Q03181 1/20 0.30
RARB P10826 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
SCHEMBL8944489 0.99 FPR2 (0.34) FPR2GABRA1GABRB2RARB
SCHEMBL8944483 0.99 FPR2 (0.34) FPR2GABRA1GABRB2RARB
SCHEMBL8944487 0.97 FPR2 (0.33) FPR2PPARD
SCHEMBL8944502 0.95 FPR2 (0.37) FPR2GABRA1GABRB2
SCHEMBL8944202 0.92 FPR2 (0.35) FPR2
SCHEMBL13579248 0.91 CHRM2 (0.32) FPR2
SCHEMBL8944070 0.90 GABRA1 (0.36) FPR2GABRA1GABRB2PPARDRARB
SCHEMBL8944080 0.90 GABRA1 (0.35) FPR2GABRA1GABRB2PPARDRARB
SCHEMBL8944431 0.90 GABRA1 (0.35) FPR2GABRA1GABRB2PPARDRARB
SCHEMBL8944441 0.90 GABRA1 (0.35) FPR2GABRA1GABRB2PPARDRARB

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