SCHEMBL14413637

SCHEMBL14413637

CCOC1CCC(C)(N2CCC(Nc3cc(C)cc(F)c3N)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 15/20 0.55
CHRM5 P08912 15/20 0.55
CHRM1 P11229 15/20 0.55
CHRM3 P20309 14/20 0.55
CHRM2 P08172 13/20 0.55
CCR5 P51681 2/20 0.31
BRD4 O60885 1/20 0.30
MAPK7 Q13164 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
SCHEMBL2280175 1.00 CHRM4 (0.55) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL2274955 1.00 CHRM4 (0.55) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL2280188 0.92 CHRM4 (0.48) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL2275630 0.91 CHRM4 (0.46) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL2275625 0.91 CHRM4 (0.46) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL2273660 0.89 CHRM2 (0.42) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL2273666 0.89 CHRM2 (0.42) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL3020781 0.88 CHRM4 (0.52) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL3021197 0.88 CHRM4 (0.52) CHRM4CHRM5CHRM1CHRM3CHRM2
SCHEMBL2275206 0.87 CHRM4 (0.44) CHRM4CHRM5CHRM1CHRM3CHRM2

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
WO-2007107567-A1 BENZIMIDAZOLES WHICH HAVE ACTIVITY AT M1 RECEPTOR AND THEIR USES IN MEDICINE GLAXO GROUP LIMITED (GB) 2007-09-27 WO disclosed