⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2610339 | 0.88 | DGKA (0.54) | — | |
| SCHEMBL16342073 | 0.86 | DGKA (0.52) | — | |
| SCHEMBL11791883 | 0.86 | DGKA (0.63) | — | |
| Ethylene Glycol Dibutanoate SCHEMBL104207 | 0.85 | DGKA (0.65) | — | |
| SCHEMBL9601098 | 0.85 | ADRA2A (0.50) | — | |
| SCHEMBL28397841 | 0.85 | NAAA (0.50) | — | |
| SCHEMBL11910509 | 0.85 | NAAA (0.50) | — | |
| SCHEMBL11785899 | 0.85 | DGKA (0.73) | — | |
| SCHEMBL14760960 | 0.83 | DGKA (0.77) | — | |
| SCHEMBL5319219 | 0.83 | DGKA (0.77) | — |
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 33 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114058173-A | Process and composition for producing flexible polyurethane foams | 赢创运营有限公司 | 2022-02-18 | — | — | CN | claimed |
| US-20220142164-A1 | HERBICIDAL COMPOUNDS | SYNGENTA CROP PROTECTION AG (CH) | 2022-05-12 | — | — | US | disclosed |
| US-20220112175-A1 | PYRIDAZINES HERBICIDAL COMPOUNDS | SYNGENTA CROP PROTECTION AG (CH) | 2022-04-14 | — | — | US | disclosed |
| US-20220104492-A1 | PYRIDAZINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH | SYNGENTA CROP PROTECTION AG (CH) | 2022-04-07 | — | — | US | disclosed |
| CN-114058173-A | Process and composition for producing flexible polyurethane foams | 赢创运营有限公司 | 2022-02-18 | — | — | CN | disclosed |
| EP-3927697-A1 | PYRIDAZINES HERBICIDAL COMPOUNDS | Syngenta Crop Protection AG (CH) | 2021-12-29 | — | — | EP | disclosed |
| EP-3923728-A1 | HERBICIDAL COMPOUNDS | Syngenta Crop Protection AG (CH) | 2021-12-22 | — | — | EP | disclosed |
| EP-3924347-A1 | PYRIDAZINIUM COMPOUNDS FOR USE IN A METHOD OF CONTROLLING UNWANTED PLANT GROWTH | Syngenta Crop Protection AG (CH) | 2021-12-22 | — | — | EP | disclosed |
| CN-113439081-A | Pyridazinium compounds for use in methods of controlling unwanted plant growth | 先正达农作物保护股份公司 | 2021-09-24 | — | — | CN | disclosed |
| CN-113423274-A | Herbicidal compounds | 先正达农作物保护股份公司 | 2021-09-21 | — | — | CN | disclosed |
| EP-1095947-A1 | NOVEL ANTIBACTERIAL COMPOUNDS | Sankyo Company Limited (JP) | 2001-05-02 | — | — | EP | disclosed |
| WO-2000015633-A1 | CONDENSED HETEROCYLIC COMPOUNDS AND HERBICIDES CONTAINING THEM | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-03-23 | — | — | WO | disclosed |
| EP-0412487-B1 | Process for the preparation of castanospermine esters | MERRELL DOW PHARMA (US) | 1994-12-28 | — | — | EP | disclosed |
| US-5243043-A | Cephalosporin antibiotics and bactericides | ROUSSEL UCLAF (FR) | 1993-09-07 | — | — | US | disclosed |
| EP-0412487-A2 | Process for the preparation of castanospermine esters | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-02-13 | — | — | EP | disclosed |
| US-4992431-A | Bactericides or antibiotics | ROUSSELUCLAF (FR) | 1991-02-12 | — | — | US | disclosed |
| US-4970317-A | Process for the preparation of castanospermine esters | MERRELL DOW PHARMACEUTICALS INC. (US) | 1990-11-13 | — | — | US | disclosed |
| US-4568759-A | Preparation of epoxides | THE DOW CHEMICAL COMPANY (US) | 1986-02-04 | — | — | US | disclosed |
| US-4398913-A | ALKALINE PASTES | CASSELLA AKTIENGESELLSCHAFT (DE) | 1983-08-16 | — | — | US | disclosed |
| US-3970678-A | Organotin mercaptide process | CINCINNATI MILACRON CHEMICALS, INC. (US) | 1976-07-20 | — | — | US | disclosed |