⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11777026 | 0.74 | — | — | |
| SCHEMBL3227325 | 0.74 | — | — | |
| SCHEMBL11398785 | 0.72 | — | — | |
| SCHEMBL28179418 | 0.70 | — | — | |
| SCHEMBL28246714 | 0.70 | ALOX15 (0.31) | — | |
| SCHEMBL166760 | 0.69 | ALOX15 (0.32) | — | |
| SCHEMBL27447686 | 0.69 | — | — | |
| SCHEMBL4457244 | 0.67 | — | — | |
| SCHEMBL841621 | 0.67 | — | — | |
| SCHEMBL28003106 | 0.65 | GAA (0.41) | — |
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-112844854-B | Flotation collector for copper oxide ore and preparation method thereof | 矿冶科技集团有限公司 | 2024-06-04 | — | — | CN | disclosed |
| CN-112844854-A | Flotation collector for copper oxide ores and preparation method thereof | 矿冶科技集团有限公司 | 2021-05-28 | — | — | CN | disclosed |