⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL104970 | 1.00 | — | — | |
| SCHEMBL19974209 | 0.86 | ALDH1A1 (0.46) | — | |
| SCHEMBL19974211 | 0.86 | ALDH1A1 (0.46) | — | |
| SCHEMBL17798935 | 0.86 | ALDH1A1 (0.46) | — | |
| SCHEMBL19973868 | 0.85 | TRPA1 (0.41) | — | |
| SCHEMBL19973870 | 0.85 | TRPA1 (0.41) | — | |
| SCHEMBL17062956 | 0.83 | ALDH1A1 (0.50) | — | |
| SCHEMBL6473740 | 0.83 | — | — | |
| SCHEMBL8581303 | 0.83 | — | — | |
| SCHEMBL17062954 | 0.83 | ALDH1A1 (0.50) | — |
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 45 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017165170-A1 | ELECTRON WITHDRAWING GROUP SUBSTITUTED AND MACROCYCLIC PGJ3 ANALOGS AND METHODS OF TREATMENT THEREOF | WILLIAM MARSH RICE UNIVERSITY (US) | 2017-09-28 | — | — | WO | claimed |
| US-7101831-B2 | Compositions of material, especially lubricants and pressure transmitting means, the production and use thereof | FUCHS PETROLUB AG (DE) | 2006-09-05 | — | — | US | claimed |
| US-20030186823-A1 | Novel compositions of material, especially lubricants and pressure transmitting means, the production and use thereof | FUCHS PETROLUB SE (DE) | 2003-10-02 | — | — | US | claimed |
| EP-0183177-A1 | Unsaturated fatty acid derivatives and their production | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1986-06-04 | — | — | EP | claimed |
| EP-0180399-A2 | Anti-tumor 4-Hydroxy-2-cyclopentenones | TEIJIN LIMITED (JP) | 1986-05-07 | — | — | EP | claimed |
| JP-62096438-A | — | — | None | — | — | JP | disclosed |
| US-10316255-B2 | Conversion of lipids into olefins | UNIV ALBERTA (CA) | 2019-06-11 | — | — | US | disclosed |
| CN-107074757-B | The manufacturing method of trifluoromethyl alkylthio chemical combination object | 组合化学工业株式会社 | 2019-05-03 | — | — | CN | disclosed |
| US-20190002766-A1 | CONVERSION OF LIPIDS INTO OLEFINS | THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) | 2019-01-03 | — | — | US | disclosed |
| US-10138430-B2 | Conversion of lipids into olefins | THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) | 2018-11-27 | — | — | US | disclosed |
| WO-2017165170-A1 | ELECTRON WITHDRAWING GROUP SUBSTITUTED AND MACROCYCLIC PGJ3 ANALOGS AND METHODS OF TREATMENT THEREOF | WILLIAM MARSH RICE UNIVERSITY (US) | 2017-09-28 | — | — | WO | disclosed |
| US-20170066973-A1 | CONVERSION OF LIPIDS INTO OLEFINS | THE GOVERNORS OF THE UNIVERSITY OF ALBERTA (CA) | 2017-03-09 | — | — | US | disclosed |
| EP-0332178-A1 | 2-cyclopentenone derivatives | TEIJIN LIMITED (JP) | 1989-09-13 | — | — | EP | disclosed |
| US-4711895-A | 4-hydroxy-2-cyclopentenone, process for production thereof, pharmaceutical composition comprising it | TEIJIN LIMITED (JP) | 1987-12-08 | — | — | US | disclosed |
| US-4711895-A | 4-hydroxy-2-cyclopentenone, process for production thereof, pharmaceutical composition comprising it | TEIJIN LIMITED (JP) | 1987-12-08 | — | — | US | disclosed |
| JP-S6296438-A | 4-HYDROXY-2-CYCLOPENTENONE AND PRODUCTION THEREOF | TEIJIN LTD | 1987-05-02 | — | — | JP | disclosed |
| EP-0183177-A1 | Unsaturated fatty acid derivatives and their production | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1986-06-04 | — | — | EP | disclosed |
| EP-0183177-A1 | Unsaturated fatty acid derivatives and their production | SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) | 1986-06-04 | — | — | EP | disclosed |
| EP-0180399-A2 | Anti-tumor 4-Hydroxy-2-cyclopentenones | TEIJIN LIMITED (JP) | 1986-05-07 | — | — | EP | disclosed |
| EP-0180399-A2 | Anti-tumor 4-Hydroxy-2-cyclopentenones | TEIJIN LIMITED (JP) | 1986-05-07 | — | — | EP | disclosed |