⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28209252 | 0.83 | — | — | |
| SCHEMBL28281918 | 0.83 | — | — | |
| SCHEMBL21328568 | 0.82 | — | — | |
| SCHEMBL27412305 | 0.82 | — | — | |
| SCHEMBL27736886 | 0.82 | — | — | |
| SCHEMBL28060685 | 0.77 | — | — | |
| SCHEMBL23612292 | 0.73 | — | — | |
| SCHEMBL29267384 | 0.73 | — | — | |
| SCHEMBL21328564 | 0.73 | — | — | |
| SCHEMBL28868900 | 0.73 | — | — |
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-220195047-U | Wear-resistant lining plate of ball mill | 靖江市永信特钢有限公司 | 2023-12-19 | — | — | CN | disclosed |