⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7553897 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL7554361 | 0.75 | — | — | |
| SCHEMBL11085135 | 0.67 | — | — | |
| SCHEMBL27521462 | 0.65 | — | — | |
| SCHEMBL5429872 | 0.61 | — | — | |
| SCHEMBL7574417 | 0.61 | — | — | |
| SCHEMBL15759804 | 0.57 | — | — | |
| SCHEMBL10655755 | 0.57 | — | — | |
| SCHEMBL17366418 | 0.57 | HIF1A (0.33) | — | |
| SCHEMBL44386 | 0.57 | — | — |
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-116507610-A | Herbicidal malonamides | 巴斯夫欧洲公司 | 2023-07-28 | — | — | CN | disclosed |