⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28875100 | 0.97 | MAOB (0.33) | — | |
| Pyridine SCHEMBL28135463 | 0.85 | TSHR (0.36) | — | |
| SCHEMBL28261628 | 0.79 | SMN1; SMN2 (0.41) | — | |
| SCHEMBL8526056 | 0.75 | — | — | |
| SCHEMBL11182253 | 0.75 | NR1H2 (0.33) | — | |
| SCHEMBL10524635 | 0.75 | ELANE (0.32) | — | |
| SCHEMBL11392917 | 0.75 | — | — | |
| Isonicotinic Acid SCHEMBL28110434 | 0.75 | NAPRT (0.53) | — | |
| SCHEMBL29027393 | 0.74 | DAO (0.33) | — | |
| SCHEMBL5720491 | 0.74 | — | — |
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 225 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117800890-B | Synthesis method of 5-trifluoromethyl pyrrole compound | 南通大学 | 2024-11-15 | — | — | CN | claimed |
| CN-117800890-A | Synthesis method of 5-trifluoromethyl pyrrole compound | 南通大学 | 2024-04-02 | — | — | CN | claimed |
| CN-117586167-A | New synthesis process of chlorfenapyr | 山东潍坊双星农药有限公司 | 2024-02-23 | — | — | CN | claimed |
| CN-108047114-B | Halogenated trifluoromethyl pyrrole derivative and preparation method and application thereof | 华东师范大学 | 2021-05-25 | — | — | CN | claimed |
| CN-110343095-A | A kind of arginine methyltransferase inhibitor and its pharmaceutical composition and purposes | 中国科学院上海药物研究所 | 2019-10-18 | — | — | CN | claimed |
| CN-107207515-B | Pyrazine compounds for the treatment of infectious diseases | 豪夫迈·罗氏有限公司 | 2019-05-28 | — | — | CN | claimed |
| CN-108863915-A | A kind of fluopyram intermediate 2- [3- chloro- 5（Trifluoromethyl）Pyridine -2- base] acetonitrile synthetic method | 山东省农药科学研究院 | 2018-11-23 | — | — | CN | claimed |
| EP-3245206-A1 | PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES | F. Hoffmann-La Roche AG (CH) | 2017-11-22 | — | — | EP | claimed |
| CN-107207515-A | Pyrazine compounds for the treatment of infectious diseases | 豪夫迈·罗氏有限公司 | 2017-09-26 | — | — | CN | claimed |
| CN-106234381-A | A kind of thiadiazoles 2 thio-ether type compounds containing trifluoromethyl pyrazol is as the application of antibacterial | 浙江工业大学 | 2016-12-21 | — | — | CN | claimed |
| WO-2016113273-A1 | PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES | F. HOFFMANN-LA ROCHE AG (CH) | 2016-07-21 | — | — | WO | claimed |
| US-20120222557-A1 | IONIC LIQUIDS COMPRISING HETERAROMATIC ANIONS | UNIVERSITY OF NOTRE DAME DU LAC (US) | 2012-09-06 | — | — | US | claimed |
| WO-2011056895-A1 | IONIC LIQUIDS COMPRISING HETERAROMATIC ANIONS | UNIVERSITY OF NOTRE DAME DU LAC (US) | 2011-05-12 | — | — | WO | claimed |
| US-20100004239-A1 | Pyrrolo [3,2-C] Pyridine-4-One 2-Indolinone Protein Kinase Inhibitors | SHANGHAI HENGRUI PHARMACEUTICAL CO., LTD. (CN) | 2010-01-07 | — | — | US | claimed |
| CN-1052726-C | 7-azabicyclo-[2,2,1]-heptane and-heptene derivatives as analgesics and anti-inflammatory agents | UNIV VIRGINIA (US) | 2000-05-24 | — | — | CN | claimed |
| CN-1045434-C | N-oxy-and thioalkylcarbonyloxyaikylpyrrole insecticidal, acaricidal and molluscicidal agents | AMERICAN CYANAMID CO (US) | 1999-10-06 | — | — | CN | claimed |
| EP-0487870-B1 | Insecticidal and acaricidal diarylpyrrolecarbonitrile and diarylnitropyrrole compounds | AMERICAN CYANAMID CO (US) | 1996-12-18 | — | — | EP | claimed |
| CN-1133045-A | 7-azabicyclo-[2,2,1]-heptane and-heptene derivatives as analgesics and anti-inflammatory agents | UNIV VIRGINIA (US) | 1996-10-09 | — | — | CN | claimed |
| EP-0691971-A1 | 7-AZABICYCLO- 2.2.1]-HEPTANE AND -HEPTENE DERIVATIVES AS ANALGESICS AND ANTI-INFLAMMATORY AGENTS | UNIVERSITY OF VIRGINIA (US) | 1996-01-17 | — | — | EP | claimed |
| CN-1107155-A | Thienyl- and furylpyrrole insecticidal and acaridical agents | AMERICAN CYANAMID CO (US) | 1995-08-23 | — | — | CN | claimed |