SCHEMBL381835

SCHEMBL381835

CNCc1cccc(C(=O)N(C)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)c1

nearest known ligand 0.66

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.66
CHRM3 P20309 19/20 0.60
ADRB2 P07550 1/20 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
SCHEMBL266141 0.89 CHRM2 (0.69) CHRM2CHRM3
SCHEMBL267952 0.87 CHRM2 (0.62) CHRM2CHRM3
SCHEMBL267098 0.87 CHRM2 (0.62) CHRM2CHRM3
SCHEMBL266338 0.86 CHRM2 (0.65) CHRM2CHRM3
SCHEMBL13430601 0.86 CHRM2 (0.76) CHRM2CHRM3ADRB2
SCHEMBL2455843 0.86 CHRM2 (0.61) CHRM2CHRM3
SCHEMBL643788 0.86 CHRM2 (0.60) CHRM2CHRM3
SCHEMBL783859 0.86 CHRM2 (0.67) CHRM2CHRM3ADRB2
SCHEMBL265513 0.86 CHRM2 (0.60) CHRM2CHRM3
SCHEMBL3770527 0.86 CHRM2 (0.68) CHRM2CHRM3ADRB2

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
US-8476253-B2 Amide derivative DAIICHI SANKYO COMPANY, LIMITED (JP) 2013-07-02 US disclosed
EP-2409977-A1 AMIDE DERIVATIVE Daiichi Sankyo Company, Limited (JP) 2012-01-25 EP disclosed