⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1205933 | 0.75 | — | — | |
| SCHEMBL30969434 | 0.75 | — | — | |
| SCHEMBL16053758 | 0.75 | — | — | |
| SCHEMBL31098891 | 0.67 | — | — | |
| SCHEMBL145798 | 0.67 | — | — | |
| SCHEMBL1982536 | 0.50 | — | — | |
| SCHEMBL38655494 | 0.50 | — | — | |
| SCHEMBL50369 | 0.50 | — | — | |
| SCHEMBL20597925 | 0.50 | — | — | |
| SCHEMBL291 | 0.50 | — | — |
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-118213506-A | Negative electrode material of sodium ion battery and preparation method and application thereof | 齐齐哈尔大学 | 2024-06-18 | — | — | CN | disclosed |