SCHEMBL9694579

SCHEMBL9694579

O=C(O)N1CCC[C@@H]1C#CCN1CCCC1

nearest known ligand 0.75

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 9/20 0.75
CHRM4 P08173 9/20 0.75
CHRM5 P08912 9/20 0.75
CHRM1 P11229 9/20 0.75
CHRM3 P20309 9/20 0.75

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
SCHEMBL9695047 1.00 CHRM2 (0.75) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9022299 1.00 CHRM2 (0.75) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9023113 0.86 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9022422 0.86 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9022978 0.86 CHRM2 (0.73) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9022840 0.86 CHRM2 (0.73) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9022427 0.86 CHRM2 (1.00) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9693370 0.83 CHRM2 (0.69) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9693487 0.83 CHRM2 (0.69) CHRM2CHRM4CHRM5CHRM1CHRM3
SCHEMBL9693359 0.83 CHRM2 (0.69) CHRM2CHRM4CHRM5CHRM1CHRM3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5001142-A Alzheimer's disease AMERICAN CYANAMID COMPANY (US) 1991-03-19 US claimed
US-5128483-A CNS Disorders AMERICAN CYANAMID COMPANY (US) 1992-07-07 US disclosed
US-5001142-A Alzheimer's disease AMERICAN CYANAMID COMPANY (US) 1991-03-19 US disclosed
EP-0408879-A2 1-Substituted-2-(3-amino-1-propynyl)-pyrrolidine derivatives AMERICAN CYANAMID COMPANY (US) 1991-01-23 EP disclosed