SCHEMBL8949865

SCHEMBL8949865

C=CCCC1COC(c2ccc(-c3ccc(-c4ccc(OCCCCCCCCC)c(F)c4F)cc3)c(F)c2)OC1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.33
FPR2 P25090 2/20 0.32
GABRA1 P14867 1/20 0.32
GABRB2 P47870 1/20 0.32
RARB P10826 1/20 0.32
CNR1 P21554 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
SCHEMBL8949586 1.00 CNR2 (0.33) CNR2FPR2GABRA1GABRB2RARB
SCHEMBL8949787 1.00 CNR2 (0.33) CNR2FPR2GABRA1GABRB2RARB
SCHEMBL8949655 1.00 CNR2 (0.33) CNR2FPR2GABRA1GABRB2RARB
SCHEMBL8949615 0.99 CNR2 (0.33) CNR2FPR2GABRA1GABRB2RARB
SCHEMBL8949731 0.96 CNR2 (0.34) CNR2FPR2GABRA1GABRB2CNR1
SCHEMBL8949875 0.95 CNR2 (0.31) CNR2FPR2GABRA1GABRB2
SCHEMBL8949621 0.94 FPR2 (0.35) FPR2GABRA1GABRB2
SCHEMBL8949495 0.91 KDM1A (0.35) FPR2
SCHEMBL8948479 0.91 FPR2 (0.35) FPR2RARB
SCHEMBL8948294 0.91 FPR2 (0.35) FPR2RARB

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