⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11524854 | 0.86 | — | — | |
| SCHEMBL2046003 | 0.86 | — | — | |
| SCHEMBL5935117 | 0.82 | — | — | |
| SCHEMBL20911218 | 0.73 | — | — | |
| SCHEMBL9012801 | 0.69 | — | — | |
| SCHEMBL9012799 | 0.69 | — | — | |
| SCHEMBL19899155 | 0.69 | — | — | |
| SCHEMBL16287874 | 0.69 | — | — | |
| SCHEMBL16287873 | 0.69 | — | — | |
| SCHEMBL19507909 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6197802-B1 | FOR AGRICULTURE | AMERICAN CYANAMID CO. | 2001-03-06 | — | — | US | claimed |
| EP-0975613-A1 | FUNGICIDAL MELITHIAZOLE DERIVATIVES | Gesellschaft für biotechnologische Forschung mbH (GBF) (DE) | 2000-02-02 | — | — | EP | claimed |
| WO-1998046583-A1 | FUNGICIDAL MELITHIAZOLE DERIVATIVES | GESELLSCHAFT FÜR BIOTECHNOLOGISCHE FORSCHUNG, MBH (DE) | 1998-10-22 | — | — | WO | claimed |