SCHEMBL23744499

SCHEMBL23744499

C[C@H]1CN(c2ncc(C#N)cn2)CCN1C(=O)NC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.76

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 11/20 0.76
CHRM2 P08172 8/20 0.63
CHRM1 P11229 6/20 0.61
CHRM3 P20309 3/20 0.60
CHRM5 P08912 1/20 0.60

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
SCHEMBL23744244 1.00 CHRM4 (0.76) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744280 0.92 CHRM4 (0.65) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744162 0.91 CHRM4 (0.64) CHRM4CHRM2CHRM1CHRM3
SCHEMBL23744242 0.89 CHRM4 (0.75) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744642 0.89 CHRM4 (0.75) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744243 0.89 CHRM4 (0.75) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL26430257 0.89 CHRM2 (0.75) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL26089159 0.88 CHRM4 (0.65) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL26089765 0.88 CHRM4 (0.65) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744502 0.88 CHRM4 (0.59) CHRM4CHRM2CHRM1CHRM3CHRM5

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-2021158698-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. (US) 2021-08-12 WO disclosed