⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5461236 | 0.66 | — | — | |
| Potassium SCHEMBL30723002 | 0.64 | — | — | |
| SCHEMBL361186 | 0.60 | — | — | |
| SCHEMBL11531223 | 0.59 | — | — | |
| SCHEMBL3653273 | 0.58 | HCAR2 (0.32) | — | |
| SCHEMBL21621209 | 0.56 | — | — | |
| SCHEMBL22801155 | 0.54 | — | — | |
| SCHEMBL3377754 | 0.52 | — | — | |
| Mellitic Acid SCHEMBL22971 | 0.45 | CYP1A2 (0.50) | — | |
| SCHEMBL9635649 | 0.45 | CA1 (0.40) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105473558-B | Aromatic yl sulfide derivative and aryl oxysulfide derivative as acaricide and insecticide | 拜耳作物科学股份公司 | 2019-04-19 | — | — | CN | disclosed |
| CN-1021653-C | 4,5-Dihydro-1H-1,2,4-triazole-3-carboxamide derivatives and herbicidal composition containing same | KUREHA CHEMICAL IND CO LTD (JP) | 1993-07-21 | — | — | CN | disclosed |
| EP-0284422-B1 | 4,5-DIHYDRO-1H-1,2,4-TRIAZOLE-3-CARBOXAMIDE DERIVATIVES AND HERBICIDAL COMPOSITION CONTAINING THE SAME | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1992-07-15 | — | — | EP | disclosed |
| US-4983209-A | NONPHYTOTOXIC | KUREHA KAGAKU KOGYO KABUSHIKI KAISHA (JP) | 1991-01-08 | — | — | US | disclosed |
| CN-88101740-A | 4, 5-dihydro-1H-1, 2, 4-triazole-3-carboxamide derivatives and herbicidal compositions thereof | — | 1988-10-19 | — | — | CN | disclosed |