SCHEMBL24945756

SCHEMBL24945756

C[C@@H]1CN(c2ncc(O)cn2)C[C@H](C)N1C(=O)OC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.56

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 10/20 0.56
CHRM4 P08173 10/20 0.55
CHRM1 P11229 7/20 0.54
CHRM3 P20309 3/20 0.48
CHRM5 P08912 1/20 0.47

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
SCHEMBL23744305 0.92 CHRM2 (0.66) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL23744124 0.91 CHRM2 (0.55) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL23744734 0.91 CHRM2 (0.55) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL24945758 0.91 CHRM2 (0.55) CHRM2CHRM4CHRM1CHRM3
SCHEMBL23744293 0.91 CHRM4 (0.66) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL23744286 0.91 CHRM4 (0.66) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL23744688 0.91 CHRM2 (0.55) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL23744687 0.90 CHRM2 (0.54) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL24945664 0.90 CHRM2 (0.54) CHRM2CHRM4CHRM1CHRM3CHRM5
SCHEMBL26431762 0.90 CHRM4 (0.55) CHRM2CHRM4CHRM1CHRM3

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-2023010078-A1 MUSCARINIC RECEPTOR 4 ANTAGONISTS AND METHODS OF USE NEUROCRINE BIOSCIENCES, INC. (US) 2023-02-02 WO disclosed