SCHEMBL4066525

SCHEMBL4066525

CCN=C(N)N(CC)CCCCC(N)C(=O)N1CCN(C(=O)C2(NS(=O)(=O)c3ccc(Cl)c(COc4cccc5c(C)cc(C)nc45)c3Cl)CCCC2)CC1

nearest known ligand 0.83

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 20/20 0.83

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
SCHEMBL4239230 0.91 BDKRB2 (1.00) BDKRB2
SCHEMBL4239239 0.91 BDKRB2 (1.00) BDKRB2
SCHEMBL4248314 0.89 BDKRB2 (1.00) BDKRB2
SCHEMBL4248315 0.89 BDKRB2 (1.00) BDKRB2
SCHEMBL4066511 0.88 BDKRB2 (0.80) BDKRB2
SCHEMBL4066521 0.88 BDKRB2 (0.80) BDKRB2
Trifluoroacetic Acid SCHEMBL4066566 0.87 BDKRB2 (0.93) BDKRB2
SCHEMBL4243807 0.87 BDKRB2 (0.85) BDKRB2
SCHEMBL4243798 0.87 BDKRB2 (0.85) BDKRB2
SCHEMBL4247022 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 6 patents. 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
EP-1513531-A1 BASIC NON-PEPTIDE BRADYKININ ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREFROM Menarini Ricerche S.p.A. (IT) 2005-03-16 EP claimed
WO-2003103671-A1 BASIC NON-PEPTIDE BRADYKININ ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREFROM MENARINI RICERCHE S.P.A. (IT) 2003-12-18 WO claimed
EP-1513531-B1 BASIC NON-PEPTIDE BRADYKININ ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREFROM MENARINI RICERCHE SPA (IT) 2009-10-21 EP disclosed
EP-1513531-A1 BASIC NON-PEPTIDE BRADYKININ ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREFROM Menarini Ricerche S.p.A. (IT) 2005-03-16 EP disclosed
WO-2003103671-A1 BASIC NON-PEPTIDE BRADYKININ ANTAGONISTS AND PHARMACEUTICAL COMPOSITIONS THEREFROM MENARINI RICERCHE S.P.A. (IT) 2003-12-18 WO disclosed