⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24189670 | 0.86 | — | — | |
| SCHEMBL22687519 | 0.76 | — | — | |
| SCHEMBL21238196 | 0.76 | — | — | |
| SCHEMBL29239269 | 0.76 | — | — | |
| SCHEMBL22687524 | 0.73 | — | — | |
| SCHEMBL22687525 | 0.73 | — | — | |
| SCHEMBL31303625 | 0.73 | — | — | |
| SCHEMBL14431466 | 0.72 | — | — | |
| SCHEMBL29003025 | 0.71 | — | — | |
| SCHEMBL2664511 | 0.71 | ALDH1A1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116120295-A | N-substituted imidazole formate derivative and application thereof | 成都麻沸散医药科技有限公司 | 2023-05-16 | — | — | CN | disclosed |