⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28312172 | 0.89 | — | — | |
| SCHEMBL21571781 | 0.87 | — | — | |
| SCHEMBL28121416 | 0.87 | — | — | |
| SCHEMBL10953621 | 0.87 | — | — | |
| SCHEMBL11146483 | 0.87 | — | — | |
| SCHEMBL11146482 | 0.87 | — | — | |
| SCHEMBL10349786 | 0.87 | — | — | |
| SCHEMBL23296284 | 0.82 | — | — | |
| SCHEMBL15106336 | 0.75 | — | — | |
| SCHEMBL9635004 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110029266-A | A kind of cast iron silicon-zirconium-manganese-chromium inovulant and preparation method thereof | 江苏亚峰合金材料有限公司 | 2019-07-19 | — | — | CN | claimed |
| CN-110029266-A | A kind of cast iron silicon-zirconium-manganese-chromium inovulant and preparation method thereof | 江苏亚峰合金材料有限公司 | 2019-07-19 | — | — | CN | disclosed |