SCHEMBL23744718

SCHEMBL23744718

C[C@@H]1CN(c2ncc3ccccc3n2)CCN1C(=O)NC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.59

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM4 P08173 12/20 0.59
CHRM2 P08172 6/20 0.59
CHRM1 P11229 5/20 0.58
CHRM3 P20309 4/20 0.57
CHRM5 P08912 2/20 0.57

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
SCHEMBL23744721 0.89 CHRM4 (0.60) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744710 0.89 CHRM4 (0.60) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL26087599 0.88 CHRM4 (0.51) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744711 0.88 CHRM4 (0.47) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL26430257 0.87 CHRM2 (0.75) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744126 0.85 CHRM4 (0.58) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744070 0.84 CHRM1 (0.77) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744066 0.84 CHRM1 (0.77) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744499 0.84 CHRM4 (0.76) CHRM4CHRM2CHRM1CHRM3CHRM5
SCHEMBL23744244 0.84 CHRM4 (0.76) 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