SCHEMBL4384929

SCHEMBL4384929

Cc1cc(C)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)NC4(C(=O)N5CCN(C(=O)C[C@@H](N)CCCN)CC5)CCCC4)c3Cl)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 20/20 1.00

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
Trifluoroacetic Acid SCHEMBL4065107 0.96 BDKRB2 (0.92) BDKRB2
SCHEMBL4066399 0.94 BDKRB2 (1.00) BDKRB2
SCHEMBL4066397 0.94 BDKRB2 (1.00) BDKRB2
SCHEMBL4070992 0.91 BDKRB2 (0.85) BDKRB2
SCHEMBL4248315 0.90 BDKRB2 (1.00) BDKRB2
SCHEMBL4248314 0.90 BDKRB2 (1.00) BDKRB2
SCHEMBL4070995 0.88 BDKRB2 (0.84) BDKRB2
Trifluoroacetic Acid SCHEMBL4069320 0.88 BDKRB2 (0.79) BDKRB2
SCHEMBL4240382 0.88 BDKRB2 (1.00) BDKRB2
SCHEMBL4060117 0.87 BDKRB2 (0.85) BDKRB2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1513531-B1 BASIC NON-PEPTIDE BRADYKININ ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREFROM MENARINI RICERCHE SPA (IT) 2009-10-21 EP claimed