SCHEMBL381280

SCHEMBL381280

CNCCCN(C)C(=O)c1ccc(NCCC(=O)N(C)CCN2CCC(OC(=O)Nc3ccccc3-c3ccccc3)CC2)cc1

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CHRM2 P08172 1/20 0.62
CHRM3 P20309 19/20 0.54

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
SCHEMBL380992 0.95 CHRM2 (0.60) CHRM2CHRM3
SCHEMBL381538 0.94 CHRM2 (0.58) CHRM2CHRM3
SCHEMBL381053 0.94 CHRM2 (0.60) CHRM2CHRM3
SCHEMBL380227 0.90 CHRM2 (0.60) CHRM2CHRM3
SCHEMBL380369 0.90 CHRM2 (0.58) CHRM2CHRM3
SCHEMBL10279628 0.90 CHRM2 (0.61) CHRM2CHRM3
SCHEMBL10279762 0.89 CHRM2 (0.60) CHRM2CHRM3
SCHEMBL380299 0.89 CHRM2 (0.54) CHRM2CHRM3
SCHEMBL381424 0.89 CHRM2 (0.54) CHRM2CHRM3
SCHEMBL799580 0.88 CHRM2 (0.60) CHRM2CHRM3

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