SCHEMBL2486744

SCHEMBL2486744

CCc1ccccc1N[C@@H](C(=O)OC1CN2CCC1CC2)c1ccccc1

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ CHRM3 P20309 7/20 0.56
▸ CHRNA7 P36544 2/20 0.52
▸ BCHE P06276 1/20 0.52
▸ ACHE P22303 1/20 0.52
▸ CHRM2 P08172 5/20 0.52
▸ CHRM1 P11229 5/20 0.52
▸ GAA P10253 2/20 0.50
▸ ATM Q13315 1/20 0.50
▸ CYP2D6 P10635 1/20 0.49

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
SCHEMBL13240827 1.00 CHRM3 (0.56) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL1695924 0.87 CHRM3 (0.58) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL1695927 0.87 CHRM3 (0.58) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL2509819 0.85 CHRM3 (0.56) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL13240795 0.85 CHRM3 (0.56) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL13240832 0.85 CHRM3 (0.56) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL2485977 0.85 CHRM3 (0.56) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL2484798 0.85 CHRM3 (0.58) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL13241016 0.85 CHRM3 (0.58) CHRM3CHRNA7BCHEACHECHRM2
SCHEMBL2511178 0.84 CHRM3 (0.55) CHRM3CHRNA7BCHEACHECHRM2

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-2376489-A1 Alkaloid aminoester derivatives and medicinal composition thereof Chiesi Farmaceutici S.p.A. (IT) 2011-10-19 — — EP claimed
Send feedback