SCHEMBL8567459

SCHEMBL8567459

Cc1nc2c(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)NC(=O)c4ccccc4)c3Cl)cccn2c1Br

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 15/20 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
Hydrochloric Acid SCHEMBL8559688 0.99 BDKRB2 (0.99) BDKRB2
SCHEMBL8560724 0.94 BDKRB2 (0.89) BDKRB2
Hydrochloric Acid SCHEMBL8561740 0.93 BDKRB2 (0.88) BDKRB2
SCHEMBL8569441 0.90 BDKRB2 (1.00) BDKRB2
SCHEMBL8564948 0.90 BDKRB2 (0.87) BDKRB2
Hydrochloric Acid SCHEMBL8561903 0.89 BDKRB2 (1.00) BDKRB2
SCHEMBL8569335 0.89 BDKRB2 (1.00) BDKRB2
Hydrochloric Acid SCHEMBL8562306 0.89 BDKRB2 (0.87) BDKRB2
SCHEMBL8562889 0.89 BDKRB2 (1.00) BDKRB2
SCHEMBL8566248 0.89 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