SCHEMBL20565477

SCHEMBL20565477

O=C(O)c1ccc(CCCN(C(=O)O[C@H]2CN3CCC2CC3)c2ccccc2)cc1

nearest known ligand 0.77

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 19/20 0.77
CHRM1 P11229 19/20 0.77
CHRM3 P20309 19/20 0.77
CHRM5 P08912 3/20 0.73
CHRM4 P08173 2/20 0.73

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
SCHEMBL17317400 0.90 CHRM2 (0.72) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL20565725 0.89 CHRM2 (0.64) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL19856658 0.89 CHRM2 (0.85) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL2831962 0.87 CHRM1 (1.00) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL2832235 0.84 CHRM2 (1.00) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL2834759 0.83 CHRM2 (1.00) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL19856560 0.82 CHRM2 (0.68) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL19856635 0.82 CHRM3 (0.73) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL19856624 0.82 CHRM3 (0.80) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL2832570 0.81 CHRM2 (0.75) CHRM2CHRM1CHRM3CHRM5CHRM4

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3152202-B1 3,5-DICHLORO,4-(3,4-(CYCLO-)ALKOXYPHENYL)--2-CARBONYLOXY)ETHYL)PYRIDINE DERIVATIVES AS PDE-4 INHIBITORS AND MUSCARINIC M3 RECEPTOR ANTAGONISTS CHIESI FARM SPA (IT) 2018-11-28 EP claimed
EP-3152202-B1 3,5-DICHLORO,4-(3,4-(CYCLO-)ALKOXYPHENYL)--2-CARBONYLOXY)ETHYL)PYRIDINE DERIVATIVES AS PDE-4 INHIBITORS AND MUSCARINIC M3 RECEPTOR ANTAGONISTS CHIESI FARM SPA (IT) 2018-11-28 EP disclosed