⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29971535 | 0.82 | — | — | |
| SCHEMBL31694990 | 0.82 | — | — | |
| SCHEMBL20598435 | 0.82 | — | — | |
| SCHEMBL3779810 | 0.82 | — | — | |
| SCHEMBL29085 | 0.82 | — | — | |
| SCHEMBL57933 | 0.82 | — | — | |
| SCHEMBL20162287 | 0.82 | — | — | |
| SCHEMBL20477601 | 0.82 | — | — | |
| SCHEMBL2421770 | 0.82 | — | — | |
| SCHEMBL30743625 | 0.82 | — | — |
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-117344246-A | Low-carbon high-sulfur bismuth-containing free-cutting steel and manufacturing method thereof | 鞍钢股份有限公司 | 2024-01-05 | — | — | CN | disclosed |
| EP-0212856-B1 | CONTINUOUS-CAST LOW-CARBON RESULFURIZED FREE-CUTTING STEEL | NIPPON STEEL CORPORATION (JP) | 1990-10-17 | — | — | EP | disclosed |
| US-4719079-A | MANGANESE SULFIDE | NIPPON STEEL CORPORATION (JP) | 1988-01-12 | — | — | US | disclosed |
| EP-0212856-A2 | Continuous-cast low-carbon resulfurized free-cutting steel | NIPPON STEEL CORPORATION (JP) | 1987-03-04 | — | — | EP | disclosed |