⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30940474 | 0.97 | — | — | |
| Lithium SCHEMBL30940470 | 0.95 | — | — | |
| SCHEMBL19151706 | 0.70 | — | — | |
| SCHEMBL30940469 | 0.69 | KDM4E (0.35) | — | |
| SCHEMBL19433659 | 0.68 | — | — | |
| SCHEMBL1881111 | 0.68 | — | — | |
| SCHEMBL30940440 | 0.66 | SELL (0.37) | — | |
| SCHEMBL19151707 | 0.65 | — | — | |
| Lithium SCHEMBL30940431 | 0.64 | KDM4E (0.35) | — | |
| SCHEMBL30940457 | 0.64 | SELL (0.42) | — |
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-118367119-A | Organic matter modified carbon-based negative electrode material and manufacturing method thereof | 贵州创德新能源科技有限公司 | 2024-07-19 | — | — | CN | disclosed |