SCHEMBL8946334

SCHEMBL8946334

C=CCCC1CCC(c2ccc(-c3ccc(-c4ccc(OCCCC)c(F)c4F)cc3)cc2F)CO1

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 2/20 0.32
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
CNR1 P21554 1/20 0.30
RARA P10276 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
SCHEMBL8946503 0.97 FPR2 (0.33) CNR2GABRA1GABRB2CNR1
SCHEMBL8946382 0.97 FPR2 (0.32) CNR2GABRA1GABRB2
SCHEMBL8946428 0.97 FPR2 (0.32) CNR2GABRA1GABRB2
SCHEMBL8946349 0.97 FPR2 (0.32) CNR2GABRA1GABRB2
SCHEMBL8946391 0.97 FPR2 (0.32) CNR2GABRA1GABRB2
SCHEMBL8946311 0.96 GABRA1 (0.35) GABRA1GABRB2
SCHEMBL8946396 0.93 FPR2 (0.32)
SCHEMBL8947824 0.92 CNR2 (0.32) CNR2GABRA1GABRB2CNR1
SCHEMBL8945178 0.91 RARB (0.33) RARARARB
SCHEMBL8946313 0.91

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