⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28345204 | 1.00 | TRIM24 (0.53) | — | |
| SCHEMBL106541 | 0.96 | — | — | |
| SCHEMBL28193199 | 0.92 | — | — | |
| SCHEMBL11352253 | 0.92 | TRIM24 (0.53) | — | |
| Ammonia Solution, Strong SCHEMBL19514673 | 0.92 | — | — | |
| SCHEMBL11873024 | 0.92 | — | — | |
| SCHEMBL30894513 | 0.92 | — | — | |
| SCHEMBL30921504 | 0.92 | — | — | |
| Potassium Ion SCHEMBL27557528 | 0.89 | TRIM24 (0.50) | — | |
| SCHEMBL696582 | 0.88 | — | — |
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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117986104-A | Crystallization method of 1, 3-cyclohexanedione | 青岛科技大学 | 2024-05-07 | — | — | CN | claimed |
| CN-117945871-A | Preparation method of 1, 3-cyclohexanedione sodium salt aqueous solution | 青岛科技大学 | 2024-04-30 | — | — | CN | claimed |
| CN-117142933-A | Preparation method of 1, 3-cyclohexanedione sodium salt | 青岛科技大学 | 2023-12-01 | — | — | CN | claimed |
| CN-114380674-B | Preparation method of 1, 3-cyclohexanedione | 山东智永化工产业技术研究院有限公司 | 2022-05-20 | — | — | CN | claimed |
| CN-114380674-A | Preparation method of 1, 3-cyclohexanedione | 山东智永化工产业技术研究院有限公司 | 2022-04-22 | — | — | CN | claimed |
| EP-0410727-A1 | Processes for removing allyl groups | SUNTORY LIMITED (JP) | 1991-01-30 | — | — | EP | claimed |
| CN-118084638-A | Continuous production method and device of 1, 3-cyclohexanedione | 宁波天研精开技术有限公司 | 2024-05-28 | — | — | CN | disclosed |
| CN-117986104-A | Crystallization method of 1, 3-cyclohexanedione | 青岛科技大学 | 2024-05-07 | — | — | CN | disclosed |
| CN-117986104-A | Crystallization method of 1, 3-cyclohexanedione | 青岛科技大学 | 2024-05-07 | — | — | CN | disclosed |
| CN-117945871-A | Preparation method of 1, 3-cyclohexanedione sodium salt aqueous solution | 青岛科技大学 | 2024-04-30 | — | — | CN | disclosed |
| CN-117945871-A | Preparation method of 1, 3-cyclohexanedione sodium salt aqueous solution | 青岛科技大学 | 2024-04-30 | — | — | CN | disclosed |
| CN-117945871-A | Preparation method of 1, 3-cyclohexanedione sodium salt aqueous solution | 青岛科技大学 | 2024-04-30 | — | — | CN | disclosed |
| EP-3612516-B1 | SYNTHESIS OF MESOTRIONE | GHARDA CHEMICALS LTD (IN) | 2023-12-06 | — | — | EP | disclosed |
| CN-110520410-A | The synthetic method of mesotrione | GHARDA CHEMICALS LTD | 2019-11-29 | — | — | CN | disclosed |
| CN-109232215-A | A kind of purification process of the fluoro- hydroresorcinol of 2- | 上海睿腾医药科技有限公司 | 2019-01-18 | — | — | CN | disclosed |
| WO-2018178860-A1 | SYNTHESIS OF MESOTRIONE | GHARDA CHEMICALS LIMITED (IN) | 2018-10-04 | — | — | WO | disclosed |
| EP-0597401-A2 | Production of penem | Takeda Chemical Industries, Ltd. (JP) | 1994-05-18 | — | — | EP | disclosed |
| EP-0030351-B1 | ERGOLINE DERIVATIVES, THEIR PREPARATION AND THERAPEUTIC COMPOSITION CONTAINING THEM | FARMITALIA CARLO ERBA S.p.A. (IT) | 1984-08-08 | — | — | EP | disclosed |
| US-4382940-A | ANTIDEPRESSANTS, TRANQUILLIZERS, NEUROLENTIC AGENTS, HORMONE INHIB | FARMITALIA CARLO ERBA S.P.A. (IT) | 1983-05-10 | — | — | US | disclosed |
| US-3950420-A | HERBICIDES | NIPPON SODA COMPANY, LTD. (JA) | 1976-04-13 | — | — | US | disclosed |