⚠ 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 | |
|---|---|---|---|---|
| Acetaldehyde SCHEMBL1331732 | 0.93 | — | — | |
| Acetaldehyde SCHEMBL6747 | 0.93 | — | — | |
| Acetaldehyde SCHEMBL2338299 | 0.93 | — | — | |
| Acetaldehyde SCHEMBL3945841 | 0.93 | — | — | |
| Acetaldehyde SCHEMBL20411618 | 0.93 | — | — | |
| Acetaldehyde SCHEMBL1330497 | 0.93 | — | — | |
| Acetaldehyde SCHEMBL25291303 | 0.86 | — | — | |
| Acetaldehyde SCHEMBL2384792 | 0.86 | — | — | |
| Acetaldehyde SCHEMBL20658915 | 0.86 | — | — | |
| Acetaldehyde SCHEMBL4340244 | 0.86 | — | — |
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-110072842-B | Molecules having pesticidal utility, and intermediates, compositions and methods related thereto | 科迪华农业科技有限责任公司 | 2024-02-02 | — | — | CN | disclosed |