SCHEMBL5007019

SCHEMBL5007019

Cc1cccc(N(C)C(=O)O[C@H]2C[N+]3(CCCc4ccccc4)CCC2CC3)c1-c1cccs1

nearest known ligand 0.58

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 20/20 0.58
CHRM2 P08172 19/20 0.58
CHRM1 P11229 18/20 0.58

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
SCHEMBL5011101 0.95 CHRM2 (0.56) CHRM3CHRM2CHRM1
SCHEMBL5006030 0.90 CHRM3 (0.57) CHRM3CHRM2CHRM1
SCHEMBL5011263 0.88 CHRM3 (0.54) CHRM3CHRM2CHRM1
SCHEMBL5009306 0.85 CHRM3 (0.44) CHRM3CHRM2CHRM1
SCHEMBL5007030 0.83 CHRM3 (0.41) CHRM3CHRM2CHRM1
SCHEMBL5005987 0.81 CHRM3 (0.43) CHRM3CHRM2CHRM1
SCHEMBL2835104 0.78 CHRM2 (0.76) CHRM3CHRM2CHRM1
SCHEMBL2816830 0.78 CHRM3 (0.76) CHRM3CHRM2CHRM1
SCHEMBL2830629 0.77 CHRM2 (0.67) CHRM3CHRM2CHRM1
SCHEMBL2816167 0.76 CHRM3 (0.60) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1461336-B1 1-ALKYL-1-AZONIABICYCLO (2.2.2) OCTANE CARBAMATE DERIVATIVES AND THEIR USE AS MUSCARINIC RECEPTOR ANTAGONISTS CHIESI FARMA SPA (IT) 2013-05-22 EP disclosed
EP-1918277-A2 Azulene compounds Industrial Technology Research Institute (TW) 2008-05-07 EP disclosed