SCHEMBL23744441

SCHEMBL23744441

N#Cc1cnc(N2CC3CCC(C2)N3C(=O)NC2CCN(Cc3ccccc3)CC2)nc1

nearest known ligand 0.75

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 2/20 0.75
CHRM5 P08912 1/20 0.75
CHRM1 P11229 1/20 0.75
CHRM4 P08173 12/20 0.61
CHRM2 P08172 4/20 0.61
PRKAA2 P54646 3/20 0.54

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
SCHEMBL23744495 0.95 CHRM3 (0.69) CHRM3CHRM5CHRM1CHRM4CHRM2
SCHEMBL26430563 0.95 CHRM3 (0.70) CHRM3CHRM5CHRM1CHRM4CHRM2
SCHEMBL23744243 0.90 CHRM4 (0.75) CHRM3CHRM5CHRM1CHRM4CHRM2
SCHEMBL23744642 0.90 CHRM4 (0.75) CHRM3CHRM5CHRM1CHRM4CHRM2
SCHEMBL23744242 0.90 CHRM4 (0.75) CHRM3CHRM5CHRM1CHRM4CHRM2
SCHEMBL26429256 0.88 CHRM3 (0.63) CHRM3CHRM5CHRM1CHRM4CHRM2
SCHEMBL29432098 0.86 CHRM3 (1.00) CHRM3CHRM5CHRM1CHRM4CHRM2
SCHEMBL26430653 0.85 CHRM4 (0.71) CHRM3CHRM5CHRM1CHRM4CHRM2
SCHEMBL23744497 0.84 CHRM5 (0.56) CHRM3CHRM5CHRM1CHRM4CHRM2
SCHEMBL23744439 0.84 CHRM5 (0.56) CHRM3CHRM5CHRM1CHRM4CHRM2

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