⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6895142 | 0.74 | — | — | |
| SCHEMBL10399859 | 0.69 | — | — | |
| SCHEMBL10399857 | 0.69 | — | — | |
| SCHEMBL27872264 | 0.69 | — | — | |
| SCHEMBL7614582 | 0.67 | — | — | |
| SCHEMBL1287802 | 0.67 | — | — | |
| SCHEMBL1287804 | 0.67 | — | — | |
| SCHEMBL29233496 | 0.67 | — | — | |
| SCHEMBL8845256 | 0.65 | — | — | |
| SCHEMBL6357830 | 0.65 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117858619-A | Herbicide malonamide | 巴斯夫欧洲公司 | 2024-04-09 | — | — | CN | disclosed |
| CN-117603025-A | Process for preparing alpha, beta unsaturated aldehydes by oxidizing alcohols in the presence of a liquid phase | 巴斯夫欧洲公司 | 2024-02-27 | — | — | CN | disclosed |
| CN-116867372-A | [ (5-phenyl-1-heteroaryl-1H-pyrazol-3-yl) oxy ] acetic acid derivatives as safeners for protecting useful plants and crop plants | 拜耳公司 | 2023-10-10 | — | — | CN | disclosed |
| CN-116514816-A | Pyrimidinone pyrrole derivative and preparation method and medical application thereof | 深圳信立泰药业股份有限公司 | 2023-08-01 | — | — | CN | disclosed |