SCHEMBL8567331

SCHEMBL8567331

CCCCCCC(=O)NCC(=O)N(C)c1ccc(Cl)c(COc2cccn3c(Br)c(C)nc23)c1Cl

nearest known ligand 0.99

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 10/20 0.99

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 SCHEMBL8564399 0.99 BDKRB2 (0.97) BDKRB2
SCHEMBL8561923 0.99 BDKRB2 (1.00) BDKRB2
Hydrochloric Acid SCHEMBL8565677 0.99 BDKRB2 (0.99) BDKRB2
SCHEMBL8566314 0.97 BDKRB2 (0.96) BDKRB2
Hydrochloric Acid SCHEMBL8568361 0.96 BDKRB2 (0.94) BDKRB2
SCHEMBL8565579 0.94 BDKRB2 (1.00) BDKRB2
Hydrochloric Acid SCHEMBL8563441 0.93 BDKRB2 (0.98) BDKRB2
SCHEMBL8568642 0.91 BDKRB2 (0.88) BDKRB2
SCHEMBL8566292 0.91 BDKRB2 (0.87) BDKRB2
SCHEMBL8567827 0.90 BDKRB2 (0.87) 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