SCHEMBL3775855

SCHEMBL3775855

O=C(O[C@H]1C[N+]2(CCOc3ccccc3)CCC1CC2)C(Nc1ccccc1)c1ccccc1

nearest known ligand 0.57

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 20/20 0.57
CHRM2 P08172 14/20 0.55
CHRM1 P11229 11/20 0.55

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
SCHEMBL13240867 1.00 CHRM3 (0.57) CHRM3CHRM2CHRM1
SCHEMBL2507102 1.00 CHRM3 (0.57) CHRM3CHRM2CHRM1
SCHEMBL13240865 0.95 CHRM3 (0.62) CHRM3CHRM2CHRM1
SCHEMBL12014463 0.95 CHRM3 (0.62) CHRM3CHRM2CHRM1
SCHEMBL3782000 0.95 CHRM3 (0.62) CHRM3CHRM2CHRM1
Trifluoroacetic Acid SCHEMBL2990371 0.93 CHRM3 (0.53) CHRM3CHRM2CHRM1
Trifluoroacetic Acid SCHEMBL9984393 0.93 CHRM3 (0.53) CHRM3CHRM2CHRM1
Trifluoroacetic Acid SCHEMBL2487985 0.93 CHRM3 (0.53) CHRM3CHRM2CHRM1
Trifluoroacetic Acid SCHEMBL2989743 0.88 CHRM3 (0.55) CHRM3CHRM2CHRM1
Trifluoroacetic Acid SCHEMBL2485505 0.88 CHRM3 (0.55) CHRM3CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2376489-B1 ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITION THEREOF CHIESI FARMA SPA (IT) 2015-04-22 EP claimed
US-8835682-B2 Alkaloid aminoester derivatives and medicinal composition thereof CHIESI FARMACEUTICI S.P.A. (IT) 2014-09-16 US disclosed
WO-2012110462-A1 LIQUID PROPELLANT-FREE FORMULATION COMPRISING AN ANTIMUSCARINIC DRUG CHIESI FARMACEUTICI S.P.A. (IT) 2012-08-23 WO disclosed
EP-2206712-A1 \"Alkaloid aminoester derivatives and medicinal composition thereof\ CHIESI FARMACEUTICI S.p.A. (IT) 2010-07-14 EP disclosed
EP-2206712-A1 \"Alkaloid aminoester derivatives and medicinal composition thereof\ CHIESI FARMACEUTICI S.p.A. (IT) 2010-07-14 EP disclosed