⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL213695 | 0.95 | — | — | |
| SCHEMBL12005226 | 0.90 | — | — | |
| SCHEMBL29084440 | 0.90 | — | — | |
| SCHEMBL7901644 | 0.67 | — | — | |
| SCHEMBL11804672 | 0.57 | — | — | |
| SCHEMBL5037258 | 0.57 | — | — | |
| SCHEMBL2241745 | 0.57 | — | — | |
| SCHEMBL738616 | 0.56 | — | — | |
| SCHEMBL19090 | 0.56 | — | — | |
| SCHEMBL2374264 | 0.55 | — | — |
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-115041232-B | Hydroformylation catalyst, preparation method and application thereof in aldehyde preparation from mixed olefins | 中海油天津化工研究设计院有限公司 | 2023-12-12 | — | — | CN | disclosed |