⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10834774 | 0.79 | — | — | |
| SCHEMBL29150224 | 0.74 | — | — | |
| SCHEMBL18666201 | 0.74 | — | — | |
| SCHEMBL1470791 | 0.74 | — | — | |
| SCHEMBL28760996 | 0.72 | — | — | |
| SCHEMBL10959478 | 0.72 | — | — | |
| SCHEMBL1038664 | 0.70 | — | — | |
| SCHEMBL11786391 | 0.69 | — | — | |
| SCHEMBL11273689 | 0.69 | — | — | |
| SCHEMBL7861148 | 0.69 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115260186-B | VMAT2 inhibitor and preparation method and application thereof | 山东绿叶制药有限公司 | 2024-05-28 | — | — | CN | disclosed |
| CN-115260186-A | VMAT2 inhibitor and preparation method and application thereof | 山东绿叶制药有限公司 | 2022-11-01 | — | — | CN | disclosed |
| CN-114302883-B | VMAT2 inhibitor and preparation method and application thereof | 山东绿叶制药有限公司 | 2022-09-06 | — | — | CN | disclosed |
| CN-114302883-A | VMAT2 inhibitor and preparation method and application thereof | 山东绿叶制药有限公司 | 2022-04-08 | — | — | CN | disclosed |
| WO-2021027792-A1 | VMAT2 INHIBITOR AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 山东绿叶制药有限公司 | 2021-02-18 | — | — | WO | disclosed |
| US-8513162-B2 | Halogen-containing organosulfur compound and use thereof | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2013-08-20 | — | — | US | disclosed |
| US-20110257226-A1 | HALOGEN-CONTAINING ORGANOSULFUR COMPOUND AND USE THEREOF | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-10-20 | — | — | US | disclosed |
| EP-2376450-A1 | HALOGEN-CONTAINING ORGANOSULFUR COMPOUNDS AND USE THEREOF FOR CONTROLLING ARTHROPOD PEST | Sumitomo Chemical Company, Limited (JP) | 2011-10-19 | — | — | EP | disclosed |
| WO-2010074327-A1 | HALOGEN-CONTAINING ORGANOSULFUR COMPOUNDS AND USE THEREOF FOR CONTROLLING ARTHROPOD PEST | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2010-07-01 | — | — | WO | disclosed |
| WO-2002054931-A2 | ALPHA-AMINOBORONIC ACIDS PREPARED BY NOVEL SYNTHETIC METHODS | BRISTOL MYERS SQUIBB COMPANY P (US) | 2002-07-18 | — | — | WO | disclosed |