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Sugi Predict / Compounds / SCHEMBL8566241

SCHEMBL8566241

SCHEMBL8566241

CC(=O)N(C)c1ccc(/C=C/C(=O)NCC(=O)N(C)c2ccc(Cl)c(COc3cccn4c(Br)c(C)nc34)c2Cl)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ BDKRB2 P30411 20/20 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
SCHEMBL8566247 1.00 BDKRB2 (1.00) BDKRB2
Hydrochloric Acid SCHEMBL8565195 0.99 BDKRB2 (1.00) BDKRB2
Hydrochloric Acid SCHEMBL8565191 0.99 BDKRB2 (1.00) BDKRB2
SCHEMBL8561930 0.95 BDKRB2 (0.90) BDKRB2
SCHEMBL8562880 0.94 BDKRB2 (0.89) BDKRB2
SCHEMBL8562876 0.94 BDKRB2 (0.89) BDKRB2
Hydrochloric Acid SCHEMBL8565772 0.94 BDKRB2 (0.89) BDKRB2
SCHEMBL8565801 0.94 BDKRB2 (0.88) BDKRB2
Hydrochloric Acid SCHEMBL8566585 0.93 BDKRB2 (0.89) BDKRB2
Hydrochloric Acid SCHEMBL8566582 0.93 BDKRB2 (0.89) 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