SCHEMBL2946372

SCHEMBL2946372

CCN(NC(=O)c1cc(OC)no1)C(=O)NCc1ccc(-c2cc(Cl)cc(F)c2-c2noc(C)n2)cc1

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 20/20 0.85

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
SCHEMBL2951247 0.89 BDKRB1 (1.00) BDKRB1
SCHEMBL3032530 0.84 BDKRB1 (0.72) BDKRB1
SCHEMBL3032532 0.84 BDKRB1 (0.72) BDKRB1
SCHEMBL3264489 0.82 BDKRB1 (0.79) BDKRB1
SCHEMBL3264486 0.82 BDKRB1 (0.79) BDKRB1
SCHEMBL13214190 0.80 BDKRB1 (0.84) BDKRB1
SCHEMBL13213771 0.80 BDKRB1 (0.80) BDKRB1
SCHEMBL2950698 0.79 BDKRB1 (0.82) BDKRB1
SCHEMBL13214189 0.78 BDKRB1 (0.81) BDKRB1
SCHEMBL13213781 0.77 BDKRB1 (0.53) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2396301-A2 SMALL MOLECULE BRADYKININ B1 RECEPTOR ANTAGONISTS Jerini AG (DE) 2011-12-21 EP disclosed
WO-2010091876-A2 SMALL MOLECULE BRADYKININ B1 RECEPTOR ANTAGONISTS JERINI AG (DE) 2010-08-19 WO disclosed
WO-2010091876-A2 SMALL MOLECULE BRADYKININ B1 RECEPTOR ANTAGONISTS JERINI AG (DE) 2010-08-19 WO disclosed