SCHEMBL19856576

SCHEMBL19856576

O=C(O)c1cccc(CN(C(=O)O[C@H]2CN3CCC2CC3)c2cccc(Cl)c2)c1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 18/20 0.67
CHRM2 P08172 17/20 0.67
CHRM1 P11229 17/20 0.67
TSHR P16473 1/20 0.55
RXFP1 Q9HBX9 1/20 0.55
CHRM5 P08912 3/20 0.52
CHRM4 P08173 2/20 0.52
PDE2A O00408 1/20 0.52
PDE6D O43924 1/20 0.52
PDE8A O60658 1/20 0.52
PDE5A O76074 1/20 0.52
PDE9A O76083 1/20 0.52
PDE8B O95263 1/20 0.52
PDE6A P16499 1/20 0.52
PDE6G P18545 1/20 0.52
PDE4A P27815 1/20 0.52
PDE6B P35913 1/20 0.52
PDE6C P51160 1/20 0.52
PDE1A P54750 1/20 0.52
PDE1B Q01064 1/20 0.52

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
SCHEMBL19856624 0.91 CHRM3 (0.80) CHRM3CHRM2CHRM1CHRM5CHRM4
SCHEMBL1924497 0.91 CHRM2 (0.80) CHRM3CHRM2CHRM1TSHRRXFP1
SCHEMBL15761782 0.90 CHRM3 (0.64) CHRM3CHRM2CHRM1TSHRRXFP1
SCHEMBL19856615 0.90 CHRM3 (0.68) CHRM3CHRM2CHRM1CHRM5CHRM4
SCHEMBL19856565 0.89 CHRM3 (0.85) CHRM3CHRM2CHRM1CHRM5CHRM4
SCHEMBL19856597 0.89 CHRM3 (0.67) CHRM3CHRM2CHRM1CHRM5CHRM4
SCHEMBL19856652 0.87 CHRM3 (0.65) CHRM3CHRM2CHRM1CHRM5CHRM4
SCHEMBL19856642 0.87 CHRM3 (0.69) CHRM3CHRM2CHRM1CHRM5CHRM4
SCHEMBL19856590 0.86 CHRM3 (0.67) CHRM3CHRM2CHRM1CHRM5CHRM4
SCHEMBL19856548 0.86 CHRM3 (0.64) CHRM3CHRM2CHRM1CHRM5CHRM4

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