SCHEMBL14219961

SCHEMBL14219961

C[C@@H](Cc1ccc(C2CCC(CCc3cc(F)c(C#N)c(F)c3)CC2)cc1)c1ccccc1

nearest known ligand 0.33

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 4/20 0.33
EP300 Q09472 5/20 0.33
CHRM2 P08172 2/20 0.33
AOC3 Q16853 1/20 0.33
CHRM1 P11229 1/20 0.33
CXCR2 P25025 1/20 0.32
CHRM5 P08912 1/20 0.32
CNR1 P21554 1/20 0.31
CNR2 P34972 1/20 0.31
HAT1 O14929 2/20 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
SCHEMBL14219931 1.00 GRM2 (0.33) GRM2EP300CHRM2AOC3CHRM1
SCHEMBL14219598 0.93 EP300 (0.33) GRM2EP300CHRM2AOC3CHRM1
SCHEMBL14219928 0.89 AOC3 (0.37) EP300CHRM2AOC3CHRM1CHRM5
SCHEMBL14219967 0.89 AOC3 (0.37) EP300CHRM2AOC3CHRM1CHRM5
SCHEMBL14219962 0.89 SIGMAR1 (0.33)
SCHEMBL14219461 0.88 CXCR2 (0.36) GRM2EP300CXCR2CNR1CNR2
SCHEMBL14219941 0.87 GRM2 (0.34) GRM2
SCHEMBL14219960 0.87 GRM2 (0.34) GRM2
SCHEMBL14219926 0.86 HCRTR1 (0.38) CNR1
SCHEMBL14219956 0.86 HCRTR1 (0.38) CNR1

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
EP-1650285-B1 Liquid crystal composition containing an optically active compound and liquid crystal electro-optical element SEIMI CHEM KK (JP) 2008-04-30 EP disclosed