⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3824958 | 0.89 | — | — | |
| SCHEMBL31672204 | 0.87 | — | — | |
| SCHEMBL29357649 | 0.87 | — | — | |
| SCHEMBL3786706 | 0.87 | — | — | |
| SCHEMBL1560731 | 0.87 | — | — | |
| SCHEMBL29365236 | 0.87 | — | — | |
| Magnesium SCHEMBL30678040 | 0.82 | — | — | |
| SCHEMBL31337848 | 0.82 | — | — | |
| SCHEMBL11515227 | 0.75 | — | — | |
| SCHEMBL11113039 | 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-118127376-A | High-strength and high-toughness corrosion-resistant titanium-zirconium-aluminum-tin quaternary alloy and preparation method thereof | 河北工业大学 | 2024-06-04 | — | — | CN | disclosed |