⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1958551 | 1.00 | — | — | |
| SCHEMBL5562570 | 0.77 | AKR1B1 (0.45) | — | |
| SCHEMBL5562572 | 0.77 | AKR1B1 (0.45) | — | |
| SCHEMBL7522292 | 0.76 | KDM4E (0.44) | — | |
| SCHEMBL16629 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL15512431 | 0.76 | ALDH1A1 (0.39) | — | |
| SCHEMBL16062 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL16061 | 0.76 | ALDH1A1 (0.36) | — | |
| SCHEMBL16209513 | 0.73 | ALDH1A1 (0.35) | — | |
| SCHEMBL23098224 | 0.71 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9708563-B2 | Lubricating composition containing an antiwear agent | THE LUBRIZOL CORPORATION (US) | 2017-07-18 | — | — | US | disclosed |
| US-20150267140-A1 | LUBRICATING COMPOSITION CONTAINING AN ANTIWEAR AGENT | LUBRIZOL CORP (US) | 2015-09-24 | — | — | US | disclosed |
| EP-2513270-B1 | LUBRICATING COMPOSITION CONTAINING A NITRILE COMPOUND | LUBRIZOL CORP (US) | 2015-09-23 | — | — | EP | disclosed |
| US-8946135-B2 | Lubricating composition containing a nitrile compound | THE LUBRIZOL CORPORATION (US) | 2015-02-03 | — | — | US | disclosed |
| US-20120309657-A1 | Lubricating Composition Containing an Antiwear Agent | THE LUBRIZOL CORPORATION (US) | 2012-12-06 | — | — | US | disclosed |
| US-20120309655-A1 | Lubricating Composition Containing a Nitrile Compound | THE LUBRIZOL CORPORATION (US) | 2012-12-06 | — | — | US | disclosed |
| EP-2513270-A1 | LUBRICATING COMPOSITION CONTAINING A NITRILE COMPOUND | The Lubrizol Corporation (US) | 2012-10-24 | — | — | EP | disclosed |
| EP-2513272-A1 | LUBRICATING COMPOSITION CONTAINING AN ANTIWEAR AGENT | The Lubrizol Corporation (US) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011075403-A1 | LUBRICATING COMPOSITION CONTAINING AN ANTIWEAR AGENT | THE LUBRIZOL CORPORATION (US) | 2011-06-23 | — | — | WO | disclosed |
| WO-2011075401-A1 | LUBRICATING COMPOSITION CONTAINING A NITRILE COMPOUND | THE LUBRIZOL CORPORATION (US) | 2011-06-23 | — | — | WO | disclosed |