⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21106092 | 0.78 | — | — | |
| SCHEMBL15004190 | 0.63 | — | — | |
| SCHEMBL13213789 | 0.61 | — | — | |
| SCHEMBL23488356 | 0.61 | — | — | |
| SCHEMBL17120932 | 0.61 | — | — | |
| SCHEMBL16021011 | 0.59 | — | — | |
| SCHEMBL21515934 | 0.58 | — | — | |
| SCHEMBL20790305 | 0.58 | — | — | |
| SCHEMBL24772358 | 0.58 | — | — | |
| SCHEMBL20790306 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3978492-A1 | BICYCLIC COMPOUND AS RIP-1 KINASE INHIBITOR AND APPLICATION THEREOF | Medshine Discovery Inc. (CN) | 2022-04-06 | — | — | EP | disclosed |