⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5556928 | 0.94 | ALDH1A1 (0.44) | — | |
| SCHEMBL11149825 | 0.92 | ALDH1A1 (0.47) | — | |
| SCHEMBL11499173 | 0.92 | ALDH1A1 (0.47) | — | |
| SCHEMBL21144279 | 0.92 | ALDH1A1 (0.47) | — | |
| SCHEMBL14401558 | 0.86 | — | — | |
| SCHEMBL4054411 | 0.80 | MAPT (0.43) | — | |
| SCHEMBL2010135 | 0.78 | — | — | |
| SCHEMBL1101930 | 0.77 | — | — | |
| SCHEMBL2006039 | 0.73 | — | — | |
| SCHEMBL16411491 | 0.72 | ALDH1A1 (0.37) | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008105607-A1 | HETEROARYL-IMIDAZOLE DERIVATIVES AS CANNABINOID CB1 RECEPTOR ANTAGONISTS | GREEN CROSS CORPORATION (KR) | 2008-09-04 | — | — | WO | claimed |
| CN-117586203-A | Preparation method of tebuthiuron | 湖南化工研究院有限公司 | 2024-02-23 | — | — | CN | disclosed |
| WO-2019179928-A1 | SUBSTITUTED SUCCINIMIDE-3-CARBOXAMIDES, SALTS THEREOF AND THE USE THEREOF AS HERBICIDAL AGENTS | BAYER AKTIENGESELLSCHAFT (DE) | 2019-09-26 | — | — | WO | disclosed |
| CN-105669592-B | A kind of synthetic method of terbufos benzthiazuron | 盐城南方化工有限公司 | 2019-04-12 | — | — | CN | disclosed |
| CN-104903320-B | Nitrogen-containing heterocycle compound or its salt | 富士胶片株式会社 | 2018-11-13 | — | — | CN | disclosed |
| CN-106359429-B | A kind of Synergistic herbicide compositions containing terbufos benzthiazuron | 西华大学 | 2018-08-07 | — | — | CN | disclosed |
| CN-106397354-B | A kind of method for improving tebuthiuron crystal mobility | 盐城南方化工有限公司 | 2018-06-19 | — | — | CN | disclosed |
| CN-104770383-B | A kind of Herbicidal combinations and its application containing terbufos benzthiazuron and bromacil | 山东润博生物科技有限公司 | 2017-07-11 | — | — | CN | disclosed |
| CN-105524017-A | Preparation method of 2-methylamino-5-t-butyl-1,3,4-thiadiazole | JIANGSU HANLIAN BIOTECHNOLOGY CO LTD | 2016-04-27 | — | — | CN | disclosed |
| CN-102365263-B | Polymerizable composition | BASF SE | 2015-04-01 | — | — | CN | disclosed |
| EP-1919907-A2 | HETEROCYCLIC COMPOUND | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2008-05-14 | — | — | EP | disclosed |
| WO-2007026959-A2 | DERIVATIVES OF 4-PIPERAZIN-1-YL-4-BENZ0 [B] THIOPHENE SUITABLE FOR THE TREATMENT OF CNS DISORDERS | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 2007-03-08 | — | — | WO | disclosed |