SCHEMBL8565581

SCHEMBL8565581

COC(=O)c1ccc(C=CC(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccn4c(Br)c(C)nc34)c2Cl)cc1

nearest known ligand 0.88

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 20/20 0.88

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
SCHEMBL8565578 1.00 BDKRB2 (0.88) BDKRB2
SCHEMBL8568421 0.94 BDKRB2 (0.89) BDKRB2
SCHEMBL8568413 0.94 BDKRB2 (0.89) BDKRB2
SCHEMBL1773342 0.93 BDKRB2 (1.00) BDKRB2
SCHEMBL2334555 0.93 BDKRB2 (1.00) BDKRB2
SCHEMBL8565664 0.93 BDKRB2 (0.76) BDKRB2
SCHEMBL8565662 0.93 BDKRB2 (0.76) BDKRB2
Hydrochloric Acid SCHEMBL5577169 0.93 BDKRB2 (1.00) BDKRB2
Hydrochloric Acid SCHEMBL5577170 0.93 BDKRB2 (1.00) BDKRB2
SCHEMBL8560523 0.93 BDKRB2 (1.00) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0596406-B1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1998-12-16 EP disclosed
US-5574042-A ANTAGONIST FOR BRADYKININS AS ANTIALLERGENS, AUTOIMMUNE DISEASES, ANTIINFLAMMATORY AGENTS, SHOCK OR PAIN FUJISAWA PHARMACEUTICAL CO., LTD (JP) 1996-11-12 US disclosed
EP-0596406-A1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 EP disclosed