SCHEMBL20157308

SCHEMBL20157308

Cc1ccc(CN2CCN(c3ncccc3Cl)CC2)cc1C(=O)N1CCN(c2ccccc2)C[C@@H]1C

nearest known ligand 0.52

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 12/20 0.44
TRPV1 Q8NER1 4/20 0.42
CHRM2 P08172 1/20 0.42
HCRTR2 O43614 1/20 0.41
MALT1 Q9UDY8 1/20 0.41

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
SCHEMBL20157542 0.91 CHRM4 (0.49) CHRM4TRPV1CHRM2HCRTR2MALT1
SCHEMBL20156810 0.88 MTOR (0.47) CHRM4TRPV1CHRM2HCRTR2
SCHEMBL20157309 0.88 MTOR (0.47) CHRM4TRPV1CHRM2HCRTR2
SCHEMBL20157350 0.84 CHRM4 (0.41) CHRM4TRPV1CHRM2HCRTR2MALT1
SCHEMBL20157345 0.84 CHRM4 (0.41) CHRM4TRPV1CHRM2HCRTR2MALT1
SCHEMBL20141840 0.81 GRM1 (0.49) CHRM4CHRM2
SCHEMBL20141948 0.80 SMN1; SMN2 (0.51)
SCHEMBL20157075 0.79 CHRM4 (0.49) CHRM4CHRM2
SCHEMBL20157081 0.79 CHRM4 (0.49) CHRM4CHRM2
SCHEMBL20141688 0.79 MTOR (0.48)

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