⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20525343 | 0.77 | — | — | |
| SCHEMBL28877378 | 0.75 | — | — | |
| SCHEMBL622144 | 0.70 | PRSS1 (0.33) | — | |
| SCHEMBL3824267 | 0.65 | — | — | |
| SCHEMBL17221093 | 0.65 | ALDH1A1 (0.33) | — | |
| SCHEMBL13005186 | 0.63 | — | — | |
| SCHEMBL31070997 | 0.63 | — | — | |
| SCHEMBL31070988 | 0.63 | — | — | |
| Water SCHEMBL7203054 | 0.63 | GAA (0.32) | — | |
| SCHEMBL26865195 | 0.62 | MITF (0.33) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8445137-B1 | Primary battery having sloped voltage decay | QUALLION LLC (US) | 2013-05-21 | — | — | US | claimed |
| EP-4256347-B1 | DETECTION OF AN ANALYTE OF INTEREST BY CROSS SPRAY ESI MASS SPECTROMETRY | HOFFMANN LA ROCHE (CH) | 2025-07-16 | — | — | EP | disclosed |
| CN-117969636-A | Method for realizing separation of multiple targets in CE-UV detection process and application | 山东中康国创先进印染技术研究院有限公司 | 2024-05-03 | — | — | CN | disclosed |
| EP-4256347-A1 | DETECTION OF AN ANALYTE OF INTEREST BY CROSS SPRAY ESI MASS SPECTROMETRY | F. Hoffmann-La Roche AG (CH) | 2023-10-11 | — | — | EP | disclosed |
| US-20230314444-A1 | DETECTION OF AN ANALYTE OF INTEREST BY CROSS SPRAY ESI MASS SPECTROMETRY | ROCHE DIAGNOSTICS OPERATIONS, INC. | 2023-10-05 | — | — | US | disclosed |
| CN-116710783-A | Detection of target analytes by cross-spray ESI mass spectrometry | 豪夫迈·罗氏有限公司 | 2023-09-05 | — | — | CN | disclosed |
| US-20230231196-A1 | ELECTROLYTIC SOLUTION, ELECTROCHEMICAL DEVICE, AND ELECTRONIC DEVICE | NINGDE AMPEREX TECHNOLOGY LIMITED (CN) | 2023-07-20 | — | — | US | disclosed |
| CN-116322745-A | System for improving hemostatic control | 组织连接公司 | 2023-06-23 | — | — | CN | disclosed |
| WO-2022117604-A1 | DETECTION OF AN ANALYTE OF INTEREST BY CROSS SPRAY ESI MASS SPECTROMETRY | F. HOFFMANN-LA ROCHE AG (CH) | 2022-06-09 | — | — | WO | disclosed |
| US-8445137-B1 | Primary battery having sloped voltage decay | QUALLION LLC (US) | 2013-05-21 | — | — | US | disclosed |
| US-20090195847-A1 | HOLOGRAPHIC RECORDING MEDIUM | KABUSHIKI KAISHA TOSHIBA | 2009-08-06 | — | — | US | disclosed |