SCHEMBL8559735

SCHEMBL8559735

Cc1nc2c(OCc3c(Cl)ccc(N(C)C(=O)CNC(=O)CN4CCS(=O)(=O)CC4)c3Cl)cccn2c1Br

nearest known ligand 0.78

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 12/20 0.76

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 SCHEMBL8564587 0.99 BDKRB2 (0.76) BDKRB2
SCHEMBL8562289 0.94 BDKRB2 (0.79) BDKRB2
Hydrochloric Acid SCHEMBL8561768 0.93 BDKRB2 (0.80) BDKRB2
SCHEMBL8558432 0.93 BDKRB2 (0.78) BDKRB2
SCHEMBL8565498 0.93 BDKRB2 (0.78) BDKRB2
Hydrochloric Acid SCHEMBL8565888 0.92 BDKRB2 (0.78) BDKRB2
Hydrochloric Acid SCHEMBL8562579 0.92 BDKRB2 (0.78) BDKRB2
SCHEMBL8560096 0.92 BDKRB2 (0.76) BDKRB2
SCHEMBL8561779 0.92 BDKRB2 (0.76) BDKRB2
Hydrochloric Acid SCHEMBL8567333 0.91 BDKRB2 (0.76) 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