⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5180151 | 1.00 | — | — | |
| SCHEMBL298778 | 1.00 | — | — | |
| SCHEMBL519 | 1.00 | — | — | |
| SCHEMBL1331666 | 1.00 | — | — | |
| SCHEMBL11026359 | 1.00 | — | — | |
| SCHEMBL1331921 | 1.00 | — | — | |
| Ethane SCHEMBL4306978 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL308874 | 0.94 | — | — | |
| Acetone SCHEMBL22494069 | 0.94 | — | — | |
| SCHEMBL20994127 | 0.94 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-12153051-B2 | Reagents for quantitative mass spectrometry | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2024-11-26 | — | — | US | disclosed |
| US-20240272167-A1 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2024-08-15 | — | — | US | disclosed |
| US-11982674-B2 | Reagents for quantitative mass spectrometry | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2024-05-14 | — | — | US | disclosed |
| CN-117946196-A | Stable isotope labeled cholesterol-3, 4-13C2Is synthesized by the method of (2) | 上海化工研究院有限公司 | 2024-04-30 | — | — | CN | disclosed |
| EP-3304058-B1 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | HARVARD COLLEGE (US) | 2023-08-02 | — | — | EP | disclosed |
| US-20230132372-A9 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2023-04-27 | — | — | US | disclosed |
| US-20220018847-A1 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2022-01-20 | — | — | US | disclosed |
| US-20200174007-A1 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2020-06-04 | — | — | US | disclosed |
| US-20180209985-A1 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2018-07-26 | — | — | US | disclosed |
| EP-3304058-A1 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | President and Fellows of Harvard College (US) | 2018-04-11 | — | — | EP | disclosed |
| WO-2016196994-A9 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2017-03-02 | — | — | WO | disclosed |
| WO-2016196994-A1 | REAGENTS FOR QUANTITATIVE MASS SPECTROMETRY | PRESIDENT AND FELLOWS OF HARVARD COLLEGE (US) | 2016-12-08 | — | — | WO | disclosed |
| US-20110282587-A1 | COMPUTER READABLE STORAGE MEDIUMS, METHODS AND SYSTEMS FOR NORMALIZING CHEMICAL PROFILES IN BIOLOGICAL OR MEDICAL SAMPLES DETECTED BY MASS SPECTROMETRY | EMORY UNIVERSITY (US) | 2011-11-17 | — | — | US | disclosed |