⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL442095 | 0.93 | ALDH1A1 (0.33) | — | |
| Hydrochloric Acid SCHEMBL442699 | 0.92 | ALDH1A1 (0.32) | — | |
| Bromide SCHEMBL1608734 | 0.92 | ALDH1A1 (0.32) | — | |
| SCHEMBL6098447 | 0.91 | ALDH1A1 (0.31) | — | |
| SCHEMBL18287206 | 0.86 | — | — | |
| SCHEMBL29603795 | 0.83 | ALDH1A1 (0.34) | — | |
| Bromide SCHEMBL4539689 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL29603410 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL21722392 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL1947927 | 0.81 | MEN1 (0.31) | — |
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 84 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113845478-B | Intermediate, and preparation method and application thereof | 四川大学 | 2023-11-21 | — | — | CN | claimed |
| WO-2022127320-A1 | INTERMEDIATE, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 四川大学 | 2022-06-23 | — | — | WO | claimed |
| CN-114423764-A | Intermediate, preparation method and application thereof | 四川大学 | 2022-04-29 | — | — | CN | claimed |
| CN-113845478-B | Intermediate, and preparation method and application thereof | 四川大学 | 2023-11-21 | — | — | CN | disclosed |
| CN-114423764-B | Intermediate, preparation method and application thereof | 四川大学 | 2023-03-17 | — | — | CN | disclosed |
| WO-2022127320-A1 | INTERMEDIATE, AND PREPARATION METHOD THEREFOR AND APPLICATION THEREOF | 四川大学 | 2022-06-23 | — | — | WO | disclosed |
| CN-114423764-A | Intermediate, preparation method and application thereof | 四川大学 | 2022-04-29 | — | — | CN | disclosed |
| US-10584141-B2 | Recyclable metathesis catalysts | THE TRUSTEES OF BOSTON COLLEGE (US) | 2020-03-10 | — | — | US | disclosed |
| US-10457640-B2 | Synthesis of inhibitors of EZH2 | CONSTELLATION PHARMACEUTICALS, INC. (US) | 2019-10-29 | — | — | US | disclosed |
| US-20190309001-A1 | RECYCLABLE METATHESIS CATALYSTS | THE TRUSTEES OF BOSTON COLLEGE | 2019-10-10 | — | — | US | disclosed |
| EP-2574187-B1 | SQUALANE AND ISOSQUALANE COMPOSITIONS AND METHODS FOR PREPARING THE SAME | AMYRIS INC (US) | 2019-09-11 | — | — | EP | disclosed |
| EP-1329455-A1 | Metal carbene complexes, methods and intermediates for making them and their use in metathesis reactions | UNIVERSITEIT GENT (BE) | 2003-07-23 | — | — | EP | disclosed |
| EP-1313559-A2 | RECYCLABLE METATHESIS CATALYSTS | Trustees of Boston College (US) | 2003-05-28 | — | — | EP | disclosed |
| EP-1301458-A1 | SYNTHESIS OF FUNCTIONALIZED AND UNFUNCTIONALIZED OLEFINS VIA CROSS AND RING-CLOSING METATHESIS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2003-04-16 | — | — | EP | disclosed |
| US-20020137978-A1 | Synthesis of functionalized and unfunctionalized olefins via cross and ring-closing Metathesis | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2002-09-26 | — | — | US | disclosed |
| US-20020107138-A1 | Recyclable metathesis catalysts | NATIONAL SCIENCE FOUNDATION | 2002-08-08 | — | — | US | disclosed |
| WO-2002014376-A2 | RECYCLABLE METATHESIS CATALYSTS | TRUSTEES OF BOSTON COLLEGE (US) | 2002-02-21 | — | — | WO | disclosed |
| EP-1180108-A2 | IMIDAZOLIDINE-BASED METAL CARBENE METATHESIS CATALYSTS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2002-02-20 | — | — | EP | disclosed |
| WO-2002000590-A1 | SYNTHESIS OF FUNCTIONALIZED AND UNFUNCTIONALIZED OLEFINS VIA CROSS AND RING-CLOSING METATHESIS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2002-01-03 | — | — | WO | disclosed |
| WO-2000071554-A2 | IMIDAZOLIDINE-BASED METAL CARBENE METATHESIS CATALYSTS | CALIFORNIA INSTITUTE OF TECHNOLOGY (US) | 2000-11-30 | — | — | WO | disclosed |