⚠ 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 | |
|---|---|---|---|---|
| Methylene Chloride SCHEMBL11645617 | 0.71 | — | — | |
| SCHEMBL4330099 | 0.67 | — | — | |
| 1,2-Dichloroethane SCHEMBL3684534 | 0.67 | — | — | |
| SCHEMBL23961 | 0.60 | — | — | |
| SCHEMBL246902 | 0.59 | — | — | |
| SCHEMBL131283 | 0.59 | — | — | |
| SCHEMBL2016934 | 0.59 | — | — | |
| SCHEMBL514082 | 0.56 | — | — | |
| SCHEMBL9817791 | 0.56 | — | — | |
| SCHEMBL1414475 | 0.56 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4012521-A | CHLOROMETHYLAROYL SULFIDES | BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) | 1977-03-15 | — | — | US | claimed |
| CN-111269278-B | Method for selectively removing chloracetyl on end group of saccharide | 许昌学院 | 2023-03-14 | — | — | CN | disclosed |
| US-11576914-B2 | Drug for treating or preventing disorder caused by TGF-β signaling, and application thereof | THE DOSHISHA (JP) | 2023-02-14 | — | — | US | disclosed |
| WO-2022259985-A1 | PEST CONTROLLING AGENT | 日本化薬株式会社 | 2022-12-15 | — | — | WO | disclosed |
| US-20210008067-A1 | DRUG FOR TREATING OR PREVENTING DISORDER CAUSED BY TGF-ß SIGNALLING, AND APPLICATION THEREOF | THE DOSHISHA (JP) | 2021-01-14 | — | — | US | disclosed |
| CN-111269278-A | Method for selectively removing chloroacetyl at carbohydrate end group | 许昌学院 | 2020-06-12 | — | — | CN | disclosed |
| EP-3659626-A1 | DRUG FOR TREATING OR PREVENTING DISORDER CAUSED BY TGF- SIGNALLING, AND APPLICATION THEREOF | The Doshisha (JP) | 2020-06-03 | — | — | EP | disclosed |
| US-8207203-B2 | Pyridylisoxazole derivatives | ASKA PHARMACEUTICAL CO., LTD. (JP) | 2012-06-26 | — | — | US | disclosed |
| US-20090306145-A1 | Pyridylisoxazole Derivatives | ASKA PHARMACEUTICAL CO., LTD. (JP) | 2009-12-10 | — | — | US | disclosed |
| EP-2036905-A1 | PYRIDYLISOXAZOLE DERIVATIVE | ASKA Pharmaceutical Co., Ltd. (JP) | 2009-03-18 | — | — | EP | disclosed |
| US-4914206-A | ANTIBIOTICS | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1990-04-03 | — | — | US | disclosed |
| EP-0226896-A2 | Lankacidin derivatives and production thereof | Takeda Chemical Industries, Ltd. (JP) | 1987-07-01 | — | — | EP | disclosed |
| US-4012521-A | CHLOROMETHYLAROYL SULFIDES | BADISCHE ANILIN- & SODA-FABRIK AKTIENGESELLSCHAFT (DT) | 1977-03-15 | — | — | US | disclosed |