SCHEMBL4752567

SCHEMBL4752567

NC1CCCC(NC(=O)C[C@@H]2C(=O)NC=CN2S(=O)(=O)c2cccc(Cl)c2Cl)CCC1

nearest known ligand 0.65

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 20/20 0.65

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
SCHEMBL4179911 0.95 BDKRB1 (0.67) BDKRB1
SCHEMBL4179900 0.95 BDKRB1 (0.67) BDKRB1
SCHEMBL4183707 0.86 BDKRB1 (0.72) BDKRB1
SCHEMBL3535672 0.79 BDKRB1 (0.65) BDKRB1
SCHEMBL3535670 0.79 BDKRB1 (0.65) BDKRB1
SCHEMBL4171710 0.79 BDKRB1 (1.00) BDKRB1
SCHEMBL4168489 0.79 BDKRB1 (1.00) BDKRB1
SCHEMBL4697935 0.79 BDKRB1 (0.71) BDKRB1
SCHEMBL4162090 0.78 BDKRB1 (1.00) BDKRB1
SCHEMBL3538848 0.78 BDKRB1 (0.70) BDKRB1

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-1963285-A1 BRADYKININ 1 RECEPTOR ANTAGONISTS Amgen Inc. (US) 2008-09-03 EP disclosed
WO-2007067629-A1 BRADYKININ 1 RECEPTOR ANTAGONISTS AMGEN INC. (US) 2007-06-14 WO disclosed