SCHEMBL8566248

SCHEMBL8566248

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

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
BDKRB2 P30411 7/20 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 SCHEMBL8566380 0.99 BDKRB2 (1.00) BDKRB2
SCHEMBL8562160 0.97 BDKRB2 (0.94) BDKRB2
Hydrochloric Acid SCHEMBL8564981 0.96 BDKRB2 (0.94) BDKRB2
SCHEMBL8568509 0.94 BDKRB2 (0.89) BDKRB2
Hydrochloric Acid SCHEMBL8568400 0.94 BDKRB2 (0.89) BDKRB2
SCHEMBL8563017 0.94 BDKRB2 (0.88) BDKRB2
SCHEMBL8564948 0.93 BDKRB2 (0.87) BDKRB2
SCHEMBL8564489 0.93 BDKRB2 (0.86) BDKRB2
SCHEMBL8561456 0.93 BDKRB2 (0.86) BDKRB2
SCHEMBL8566492 0.93 BDKRB2 (0.86) 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