SCHEMBL381121

SCHEMBL381121

CN(CCN1CCC(OC(=O)Nc2ccccc2-c2ccccc2)CC1)C(=O)CCCCO

nearest known ligand 0.67

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CHRM3 P20309 20/20 0.67

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
SCHEMBL381227 0.99 CHRM3 (0.67) CHRM3
SCHEMBL381198 0.99 CHRM3 (0.67) CHRM3
SCHEMBL4430556 0.93 CHRM3 (0.65) CHRM3
SCHEMBL769258 0.92 CHRM3 (0.65) CHRM3
SCHEMBL380736 0.92 CHRM3 (0.75) CHRM3
SCHEMBL1191081 0.92 CHRM3 (0.65) CHRM3
SCHEMBL18239943 0.92 CHRM3 (0.68) CHRM3
SCHEMBL380326 0.91 CHRM3 (0.64) CHRM3
SCHEMBL381346 0.91 CHRM3 (0.63) CHRM3
Hydrochloric Acid SCHEMBL381304 0.91 CHRM3 (0.74) CHRM3

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