⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29065961 | 0.89 | — | — | |
| SCHEMBL28845612 | 0.89 | — | — | |
| SCHEMBL339487 | 0.87 | — | — | |
| SCHEMBL28019353 | 0.87 | — | — | |
| SCHEMBL11673767 | 0.87 | — | — | |
| SCHEMBL28845598 | 0.82 | — | — | |
| SCHEMBL29024444 | 0.75 | — | — | |
| Methane SCHEMBL28785041 | 0.75 | — | — | |
| SCHEMBL28356268 | 0.75 | — | — | |
| SCHEMBL1785125 | 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-113846253-B | Preparation method of Al-Si-Mg-Cu-Sc-Zr-Sr cast alloy | 中国航发北京航空材料研究院 | 2022-09-20 | — | — | CN | claimed |
| CN-113846253-A | Al-Si-Mg-Cu-Sc-Zr-Sr casting alloy and preparation and heat treatment method thereof | 中国航发北京航空材料研究院 | 2021-12-28 | — | — | CN | claimed |