⚠ 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 | |
|---|---|---|---|---|
| Selenium SCHEMBL29396139 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL906642 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL29353100 | 0.82 | — | — | |
| Charcoal, Activated SCHEMBL31443374 | 0.67 | — | — | |
| Charcoal, Activated SCHEMBL31718144 | 0.67 | — | — | |
| Lithium SCHEMBL31287278 | 0.67 | — | — | |
| Charcoal, Activated SCHEMBL31366370 | 0.67 | — | — | |
| Charcoal, Activated SCHEMBL31026360 | 0.67 | — | — | |
| Selenium SCHEMBL30989326 | 0.67 | — | — | |
| Water SCHEMBL29872134 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112063924-B | High-carbon selenium-tin-containing free-cutting steel and production method thereof | 鞍钢股份有限公司 | 2022-05-20 | — | — | CN | claimed |
| CN-112063924-B | High-carbon selenium-tin-containing free-cutting steel and production method thereof | 鞍钢股份有限公司 | 2022-05-20 | — | — | CN | disclosed |
| CN-112063924-B | High-carbon selenium-tin-containing free-cutting steel and production method thereof | 鞍钢股份有限公司 | 2022-05-20 | — | — | CN | disclosed |
| CN-112063924-B | High-carbon selenium-tin-containing free-cutting steel and production method thereof | 鞍钢股份有限公司 | 2022-05-20 | — | — | CN | disclosed |