SCHEMBL4248314

SCHEMBL4248314

Cc1cc(C)c2cccc(OCc3c(Cl)ccc(S(=O)(=O)NC4(C(=O)N5CCN(C(=O)C(N)CCCCN)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
SCHEMBL4248315 1.00 BDKRB2 (1.00) BDKRB2
Trifluoroacetic Acid SCHEMBL4057508 0.96 BDKRB2 (0.92) BDKRB2
SCHEMBL4239239 0.94 BDKRB2 (1.00) BDKRB2
SCHEMBL4239230 0.94 BDKRB2 (1.00) BDKRB2
SCHEMBL4240382 0.93 BDKRB2 (1.00) BDKRB2
SCHEMBL5184822 0.93 BDKRB2 (1.00) BDKRB2
SCHEMBL5184814 0.93 BDKRB2 (1.00) BDKRB2
Hydrochloric Acid SCHEMBL3550895 0.92 BDKRB2 (0.99) BDKRB2
Hydrochloric Acid SCHEMBL3550900 0.92 BDKRB2 (0.99) BDKRB2
SCHEMBL4243798 0.92 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