⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11603258 | 0.91 | — | — | |
| SCHEMBL29053235 | 0.83 | — | — | |
| SCHEMBL28484394 | 0.83 | — | — | |
| SCHEMBL28818162 | 0.83 | — | — | |
| SCHEMBL29248372 | 0.82 | — | — | |
| SCHEMBL27804683 | 0.82 | — | — | |
| SCHEMBL1626649 | 0.82 | — | — | |
| SCHEMBL28541956 | 0.77 | — | — | |
| SCHEMBL7456135 | 0.73 | — | — | |
| SCHEMBL29084172 | 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-116770110-A | Aluminum alloy die casting and preparation method thereof | 深圳市爱斯特新材料科技有限公司 | 2023-09-19 | — | — | CN | disclosed |