SCHEMBL19856658

SCHEMBL19856658

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

nearest known ligand 0.85

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 19/20 0.85
CHRM1 P11229 19/20 0.85
CHRM3 P20309 19/20 0.85
CHRM5 P08912 3/20 0.65
CHRM4 P08173 2/20 0.65

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
SCHEMBL19856635 0.92 CHRM3 (0.73) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL1926099 0.92 CHRM2 (1.00) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL2828617 0.92 CHRM2 (1.00) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL1924243 0.92 CHRM2 (1.00) CHRM2CHRM1CHRM3CHRM5CHRM4
Hydrochloric Acid SCHEMBL1925445 0.91 CHRM2 (0.98) CHRM2CHRM1CHRM3CHRM5CHRM4
Hydrochloric Acid SCHEMBL1926555 0.91 CHRM2 (0.98) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL19856825 0.91 CHRM3 (0.83) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL19856552 0.90 CHRM3 (0.69) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL2485702 0.90 CHRM3 (0.78) CHRM2CHRM1CHRM3CHRM5CHRM4
SCHEMBL5007161 0.89 CHRM1 (0.92) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2928880-B1 PHENYLETHYLPYRIDINE DERIVATIVES AS PDE4-INHIBITORS AND MUSCARINIC RECEPTOR ANTAGONISTS CHIESI FARM SPA (IT) 2018-02-14 EP claimed