SCHEMBL20157075

SCHEMBL20157075

Cc1ccc(CN2CCN(c3ccccc3C#N)CC2)cc1C(=O)N1CCN(c2ccccc2)CC1C

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 10/20 0.49
MTOR P42345 2/20 0.48
RPTOR Q8N122 2/20 0.48
MLST8 Q9BVC4 2/20 0.48
CHRM2 P08172 6/20 0.45
CHRM1 P11229 5/20 0.45
CHRM5 P08912 2/20 0.45
GRM1 Q13255 1/20 0.45

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
SCHEMBL20157081 1.00 CHRM4 (0.49) CHRM4MTORRPTORMLST8CHRM2
SCHEMBL20142175 0.95 GRM1 (0.50) CHRM4MTORRPTORMLST8CHRM2
SCHEMBL20157188 0.91 MTOR (0.55) CHRM4MTORRPTORMLST8CHRM2
SCHEMBL20157186 0.91 MTOR (0.55) CHRM4MTORRPTORMLST8CHRM2
SCHEMBL20157004 0.88 CHRM4 (0.47) CHRM4MTORRPTORMLST8CHRM2
SCHEMBL20157005 0.88 CHRM4 (0.47) CHRM4MTORRPTORMLST8CHRM2
SCHEMBL20157302 0.86 MTOR (0.43) CHRM4MTORRPTORMLST8CHRM2
SCHEMBL20157300 0.86 MTOR (0.43) CHRM4MTORRPTORMLST8CHRM2
SCHEMBL20141840 0.86 GRM1 (0.49) CHRM4MTORRPTORMLST8CHRM2
SCHEMBL20157171 0.85 GRM1 (0.43) CHRM4MTORRPTORMLST8CHRM2

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-2018089433-A1 PHENYL mTORC INHIBITORS AND USES THEREOF NAVITOR PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed