⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1197625 | 0.72 | — | — | |
| SCHEMBL11687636 | 0.61 | — | — | |
| SCHEMBL1197046 | 0.61 | — | — | |
| SCHEMBL10702340 | 0.58 | — | — | |
| SCHEMBL1586150 | 0.53 | — | — | |
| SCHEMBL10531960 | 0.52 | ALDH1A1 (0.31) | — | |
| SCHEMBL1950727 | 0.52 | — | — | |
| SCHEMBL1425050 | 0.49 | ALDH1A1 (0.33) | — | |
| SCHEMBL10691028 | 0.49 | ALDH1A1 (0.33) | — | |
| SCHEMBL10688717 | 0.49 | ALDH1A1 (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1993010103-A1 | HERBICIDAL SULFONYLURIA DERIVATIVES | ICI AUSTRALIA OPERATIONS PROPRIETARY LIMITED (AU) | 1993-05-27 | — | — | WO | claimed |
| WO-1992006965-A1 | HERBICIDAL SULFONYLUREA DERIVATIVES | ICI AUSTRALIA OPERATIONS PROPRIETARY LIMITED (AU) | 1992-04-30 | — | — | WO | claimed |
| EP-0457581-A1 | Herbicidal sulfonylurea derivatives | ICI AUSTRALIA OPERATIONS PROPRIETARY LIMITED (AU) | 1991-11-21 | — | — | EP | claimed |