SCHEMBL8561820

SCHEMBL8561820

COCCN(C)C(=O)c1cccc(NC(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccn4c(Br)c(C)nc34)c2Cl)c1

nearest known ligand 0.85

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 19/20 0.85

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 SCHEMBL8567613 0.99 BDKRB2 (0.85) BDKRB2
SCHEMBL8565606 0.95 BDKRB2 (0.85) BDKRB2
Hydrochloric Acid SCHEMBL8562194 0.94 BDKRB2 (0.85) BDKRB2
SCHEMBL8566782 0.92 BDKRB2 (1.00) BDKRB2
SCHEMBL8560639 0.91 BDKRB2 (1.00) BDKRB2
Hydrochloric Acid SCHEMBL8564207 0.91 BDKRB2 (1.00) BDKRB2
Hydrochloric Acid SCHEMBL8565591 0.91 BDKRB2 (1.00) BDKRB2
SCHEMBL8561594 0.91 BDKRB2 (1.00) BDKRB2
SCHEMBL8565473 0.90 BDKRB2 (0.87) BDKRB2
SCHEMBL8558714 0.90 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