⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL10886625 | 0.82 | — | — | |
| Water SCHEMBL1449717 | 0.82 | — | — | |
| Water SCHEMBL1339216 | 0.82 | — | — | |
| Water SCHEMBL23023598 | 0.82 | — | — | |
| Water SCHEMBL2872374 | 0.82 | — | — | |
| Water SCHEMBL23002030 | 0.82 | — | — | |
| Water SCHEMBL18529884 | 0.82 | — | — | |
| Water SCHEMBL119239 | 0.82 | — | — | |
| Water SCHEMBL2980748 | 0.82 | — | — | |
| Water SCHEMBL446266 | 0.82 | — | — |
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-117976283-B | Thermal-photoelectric conversion battery based on radioactive isotope | 兰州大学 | 2024-09-13 | — | — | CN | disclosed |
| CN-117976283-A | Thermal-photoelectric conversion battery based on radioactive isotope | 兰州大学 | 2024-05-03 | — | — | CN | disclosed |