SCHEMBL8563362

SCHEMBL8563362

Cc1nc2c(OCc3c(Cl)ccc([N+](=O)[O-])c3Cl)cccn2c1Br

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 1/20 0.59

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 SCHEMBL8562165 0.99 BDKRB2 (0.59) BDKRB2
SCHEMBL8563140 0.90
SCHEMBL8560717 0.89
SCHEMBL8564173 0.86 BDKRB2 (0.65) BDKRB2
SCHEMBL8561439 0.86 BDKRB2 (0.54) BDKRB2
SCHEMBL8560866 0.83 BDKRB2 (0.61) BDKRB2
SCHEMBL4600191 0.83 BDKRB2 (0.61) BDKRB2
SCHEMBL8566773 0.82
Hydrochloric Acid SCHEMBL8566079 0.82 BDKRB2 (0.61) BDKRB2
SCHEMBL8569543 0.81 BDKRB2 (0.55) 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
JP-7300478-A None JP disclosed
EP-0596406-B1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO (JP) 1998-12-16 EP disclosed
US-5750699-A HALOGENATING OF CORRESPONDING COMPOUND FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1998-05-12 US 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
JP-H07300478-A HETEROCYCLIC COMPOUND FUJISAWA PHARMACEUT CO LTD 1995-11-14 JP disclosed
EP-0596406-A1 Imidazo (1,2-a) Pyridines as bradykinin antagonists FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1994-05-11 EP disclosed