⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9168568 | 0.80 | — | — | |
| SCHEMBL1046193 | 0.78 | — | — | |
| SCHEMBL31557362 | 0.74 | CA2 (0.34) | — | |
| SCHEMBL8569735 | 0.74 | KDM4E (0.30) | — | |
| SCHEMBL19743514 | 0.73 | HDAC4 (0.37) | — | |
| SCHEMBL19743518 | 0.73 | HDAC4 (0.37) | — | |
| SCHEMBL19743516 | 0.73 | HDAC4 (0.37) | — | |
| SCHEMBL2738379 | 0.70 | — | — | |
| SCHEMBL11475296 | 0.67 | — | — | |
| SCHEMBL14391018 | 0.64 | SMN1; SMN2 (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 20 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2057247-B1 | ASCORBIC ACID STABILIZERS FOR FLUOROOLEFINS | DU PONT (US) | 2016-04-13 | — | — | EP | claimed |
| US-8815472-B2 | Volume hologram optical recording medium, composition for volume hologram recording layer formation, and volume hologram recording material | MITSUBISHI CHEMICAL CORPORATION (JP) | 2014-08-26 | — | — | US | claimed |
| US-10796894-B2 | System and method for ionization of molecules for mass spectrometry and ion mobility spectrometry | UNIVERSITY OF THE SCIENCES IN PHILADELPHIA (US) | 2020-10-06 | — | — | US | disclosed |
| EP-2612345-B1 | SYSTEM AND METHOD FOR IONIZATION OF MOLECULES FOR MASS SPECTROMETRY AND ION MOBILITY SPECTROMETRY | UNIV OF THE SCIENCES IN PHILADELPHIA (US) | 2020-04-08 | — | — | EP | disclosed |
| WO-2019065283-A1 | PYRIDAZINONE COMPOUND OR SALT THEREOF AND HERBICIDE CONTAINING SAME | 石原産業株式会社 | 2019-04-04 | — | — | WO | disclosed |
| US-20190096649-A1 | SYSTEM AND METHOD FOR IONIZATION OF MOLECULES FOR MASS SPECTROMETRY AND ION MOBILITY SPECTROMETRY | UNIVERSITY OF THE SCIENCES IN PHILADELPHIA (US) | 2019-03-28 | — | — | US | disclosed |
| US-10128096-B2 | System and method for ionization of molecules for mass spectrometry and ion mobility spectrometry | UNIVERSITY OF THE SCIENCES IN PHILADELPHIA (US) | 2018-11-13 | — | — | US | disclosed |
| US-9824872-B2 | Systems and methods for high throughput solvent assisted ionization inlet for mass spectrometry | WAYNE STATE UNIVERSITY (US) | 2017-11-21 | — | — | US | disclosed |
| US-20170213714-A9 | SYSTEMS AND METHODS FOR HIGH THROUGHPUT SOLVENT ASSISTED IONIZATION INLET FOR MASS SPECTROMETRY | WAYNE STATE UNIVERSITY (US) | 2017-07-27 | — | — | US | disclosed |
| US-20170148621-A1 | SYSTEM AND METHOD FOR IONIZATION OF MOLECULES FOR MASS SPECTROMETRY AND ION MOBILITY SPECTROMETRY | UNIVERSITY OF THE SCIENCES IN PHILADELPHIA (US) | 2017-05-25 | — | — | US | disclosed |
| US-9552973-B2 | System and method for ionization of molecules for mass spectrometry and ion mobility spectrometry | UNIVERSITY OF THE SCIENCES IN PHILADELPHIA (US) | 2017-01-24 | — | — | US | disclosed |
| US-20160284528-A1 | SYSTEMS AND METHODS FOR HIGH THROUGHPUT SOLVENT ASSISTED IONIZATION INLET FOR MASS SPECTROMETRY | WAYNE STATE UNIVERSITY (US) | 2016-09-29 | — | — | US | disclosed |
| US-8815472-B2 | Volume hologram optical recording medium, composition for volume hologram recording layer formation, and volume hologram recording material | MITSUBISHI CHEMICAL CORPORATION (JP) | 2014-08-26 | — | — | US | disclosed |
| US-20140166875-A1 | SYSTEMS AND METHODS FOR HIGH THROUGHPUT SOLVENT ASSISTED IONIZATION INLET FOR MASS SPECTROMETRY | WAYNE STATE UNIVERSITY (US) | 2014-06-19 | — | — | US | disclosed |
| US-20130214154-A1 | SYSTEM AND METHOD FOR IONIZATION OF MOLECULES FOR MASS SPECTROMETRY AND ION MOBILITY SPECTROMETRY | WAYNE STATE UNIVERSITY (US) | 2013-08-22 | — | — | US | disclosed |
| EP-2612345-A2 | SYSTEM AND METHOD FOR IONIZATION OF MOLECULES FOR MASS SPECTROMETRY AND ION MOBILITY SPECTROMETRY | University of the Sciences in Philadelphia (US) | 2013-07-10 | — | — | EP | disclosed |
| EP-2077471-B1 | VOLUME HOLOGRAM OPTICAL RECORDING MEDIUM, COMPOSITION FOR VOLUME HOLOGRAM RECORDING LAYER FORMATION, AND VOLUME HOLOGRAM RECORDING MATERIAL | MITSUBISHI CHEM CORP (JP) | 2012-07-25 | — | — | EP | disclosed |
| WO-2012031082-A2 | SYSTEM AND METHOD FOR IONIZATION OF MOLECULES FOR MASS SPECTROMETRY AND ION MOBILITY SPECTROMETRY | UNIVERSITY OF THE SCIENCES IN PHILADELPHIA (US) | 2012-03-08 | — | — | WO | disclosed |
| US-20100067073-A1 | VOLUME HOLOGRAM OPTICAL RECORDING MEDIUM, COMPOSITION FOR VOLUME HOLOGRAM RECORDING LAYER FORMATION, AND VOLUME HOLOGRAM RECORDING MATERIAL | MITSUBISHI CHEMICAL CORPORATION (JP) | 2010-03-18 | — | — | US | disclosed |
| EP-2077471-A1 | VOLUME HOLOGRAM OPTICAL RECORDING MEDIUM, COMPOSITION FOR VOLUME HOLOGRAM RECORDING LAYER FORMATION, AND VOLUME HOLOGRAM RECORDING MATERIAL | Mitsubishi Chemical Corporation (JP) | 2009-07-08 | — | — | EP | disclosed |