⚠ 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 | |
|---|---|---|---|---|
| Magnesium SCHEMBL29768790 | 0.87 | — | — | |
| Magnesium SCHEMBL31127518 | 0.87 | — | — | |
| SCHEMBL2843207 | 0.87 | — | — | |
| Magnesium SCHEMBL30684830 | 0.87 | — | — | |
| Magnesium SCHEMBL30524361 | 0.87 | — | — | |
| Magnesium SCHEMBL31300443 | 0.82 | — | — | |
| SCHEMBL25301997 | 0.75 | — | — | |
| SCHEMBL9685960 | 0.75 | — | — | |
| Water SCHEMBL338988 | 0.75 | — | — | |
| Magnesium SCHEMBL1833849 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118610432-A | Sodium-rich medium-entropy doped vanadium sodium fluorophosphate material and preparation method and application thereof | 西安交通大学 | 2024-09-06 | — | — | CN | disclosed |