⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL938812 | 0.87 | — | — | |
| SCHEMBL28237510 | 0.75 | — | — | |
| SCHEMBL27651435 | 0.75 | — | — | |
| SCHEMBL27443871 | 0.75 | — | — | |
| SCHEMBL9456011 | 0.75 | — | — | |
| SCHEMBL29108585 | 0.75 | — | — | |
| SCHEMBL28487084 | 0.75 | — | — | |
| Methane SCHEMBL29182267 | 0.75 | — | — | |
| SCHEMBL30096294 | 0.75 | — | — | |
| SCHEMBL27767568 | 0.75 | — | — |
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-117747174-A | Anti-radiation wire and preparation method thereof | 新凝合科技(成都)有限公司 | 2024-03-22 | — | — | CN | disclosed |