SCHEMBL23744653

SCHEMBL23744653

C[C@@H]1CN(c2cncc(C(F)(F)F)n2)[C@H](C)CN1C(=O)OC1CCN(Cc2ccccc2)CC1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 11/20 0.45
CHRM1 P11229 10/20 0.45
CHRM4 P08173 5/20 0.45
CHRM3 P20309 7/20 0.43
CHRM5 P08912 2/20 0.43
BCHE P06276 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
SCHEMBL23744649 1.00 CHRM2 (0.45) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL26432039 0.94 CHRM2 (0.42) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL26432005 0.94 CHRM2 (0.42) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL26429441 0.88 CHRM2 (0.37) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL26429445 0.88 CHRM2 (0.37) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL23744476 0.87 CHRM2 (0.57) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL23744646 0.87 CHRM2 (0.57) CHRM2CHRM1CHRM4CHRM3CHRM5
SCHEMBL23744618 0.86 CHRM4 (0.47) CHRM2CHRM1CHRM4CHRM3BCHE
SCHEMBL23744614 0.86 CHRM4 (0.47) CHRM2CHRM1CHRM4CHRM3BCHE
SCHEMBL23744482 0.85 CHRM2 (0.53) CHRM2CHRM1CHRM4CHRM3CHRM5

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