⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19471502 | 0.82 | KDM3A (0.50) | — | |
| SCHEMBL24672 | 0.82 | — | — | |
| SCHEMBL31368627 | 0.82 | — | — | |
| SCHEMBL716225 | 0.82 | — | — | |
| SCHEMBL139857 | 0.82 | — | — | |
| SCHEMBL29879169 | 0.82 | — | — | |
| SCHEMBL9700329 | 0.82 | KDM3A (0.50) | — | |
| SCHEMBL4429868 | 0.82 | — | — | |
| SCHEMBL21802721 | 0.82 | KDM3A (0.50) | — | |
| Water SCHEMBL422681 | 0.67 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114042454-B | Phosphorus-doped nickel-aluminum oxide and preparation method and application thereof | 中国科学院青岛生物能源与过程研究所 | 2023-03-31 | — | — | CN | claimed |
| CN-114042454-A | Phosphorus-doped nickel-aluminum oxide and preparation method and application thereof | 中国科学院青岛生物能源与过程研究所 | 2022-02-15 | — | — | CN | claimed |
| US-5037070-A | Melt containment apparatus with protective oxide melt contact surface | GENERAL MOTORS CORPORATION (US) | 1991-08-06 | — | — | US | disclosed |