⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL894594 | 0.76 | — | — | |
| SCHEMBL23851895 | 0.75 | TRIM24 (0.32) | — | |
| SCHEMBL15400895 | 0.74 | — | — | |
| SCHEMBL2520789 | 0.74 | — | — | |
| SCHEMBL20177077 | 0.74 | — | — | |
| SCHEMBL17796355 | 0.74 | POLB (0.37) | — | |
| SCHEMBL17796356 | 0.74 | POLB (0.37) | — | |
| SCHEMBL20757349 | 0.74 | TRIM24 (0.31) | — | |
| SCHEMBL2516598 | 0.72 | TRIM24 (0.33) | — | |
| SCHEMBL20757758 | 0.72 | CA12 (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7417152-B2 | 4-bromo-5-(2-chloro-benzoylamino)-1H-pyrazole-3-carboxylic acid amide derivatives and related compounds as bradykinin B1 receptor antagonists for the treatment of inflammatory diseases | ELAN PHARMACEUTICALS, INC. (US) | 2008-08-26 | — | — | US | disclosed |