⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28589482 | 0.90 | — | — | |
| SCHEMBL27539060 | 0.85 | — | — | |
| SCHEMBL9550763 | 0.84 | — | — | |
| SCHEMBL28419644 | 0.84 | — | — | |
| SCHEMBL27926471 | 0.83 | — | — | |
| SCHEMBL27758144 | 0.83 | — | — | |
| SCHEMBL27737407 | 0.83 | — | — | |
| SCHEMBL10539415 | 0.83 | — | — | |
| SCHEMBL28425293 | 0.81 | — | — | |
| SCHEMBL6933322 | 0.81 | — | — |
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-112961548-B | Organosilicon modified vinyl acetate ternary composition and preparation method thereof | 湖北大学 | 2021-12-03 | — | — | CN | disclosed |
| CN-112961548-A | Organosilicon modified vinyl acetate ternary composition and preparation method thereof | 湖北大学 | 2021-06-15 | — | — | CN | disclosed |