⚠ 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 | |
|---|---|---|---|---|
| Ethane SCHEMBL10659912 | 0.97 | TDP1 (0.40) | — | |
| SCHEMBL337442 | 0.79 | — | — | |
| SCHEMBL337443 | 0.79 | — | — | |
| SCHEMBL12841326 | 0.77 | — | — | |
| SCHEMBL15750870 | 0.77 | LMNA (0.40) | — | |
| SCHEMBL3583584 | 0.74 | SPHK2 (0.37) | — | |
| SCHEMBL3583586 | 0.74 | SPHK2 (0.37) | — | |
| SCHEMBL20880238 | 0.74 | ALDH1A1 (0.30) | — | |
| SCHEMBL25058928 | 0.72 | SPHK2 (0.40) | — | |
| SCHEMBL28534554 | 0.71 | SPHK2 (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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0948357-A1 | USE OF LOW MOLECULAR WEIGHT AMINO ALCOHOLS IN OPHTHALMIC COMPOSITIONS | ALCON LABORATORIES, INC. (US) | 1999-10-13 | — | — | EP | claimed |
| WO-1998025649-A1 | USE OF LOW MOLECULAR WEIGHT AMINO ALCOHOLS IN OPHTHALMIC COMPOSITIONS | ALCON LABORATORIES, INC. (US) | 1998-06-18 | — | — | WO | claimed |
| EP-2563505-A2 | DISPERSANT COMPOSITION | Lubrizol Advanced Materials, Inc. (US) | 2013-03-06 | — | — | EP | disclosed |
| EP-2513270-A1 | LUBRICATING COMPOSITION CONTAINING A NITRILE COMPOUND | The Lubrizol Corporation (US) | 2012-10-24 | — | — | EP | disclosed |
| WO-2011139580-A2 | DISPERSANT COMPOSITION | LUBRIZOL ADVANCED MATERIALS, INC. (US) | 2011-11-10 | — | — | WO | disclosed |
| WO-2011075401-A1 | LUBRICATING COMPOSITION CONTAINING A NITRILE COMPOUND | THE LUBRIZOL CORPORATION (US) | 2011-06-23 | — | — | WO | disclosed |
| CN-1305459-C | Personal care compositions with hydroxy amine neutralized polymers | UNILEVER NV (NL) | 2007-03-21 | — | — | CN | disclosed |
| EP-1692249-A2 | LUBRICATING COMPOSITION CONTAINING METAL SALIXARATE AS DETERGENT | The Lubrizol Corporation (US) | 2006-08-23 | — | — | EP | disclosed |
| CN-1655756-A | Personal care compositions with hydroxy amine neutralized polymers | UNILEVER NV (NL) | 2005-08-17 | — | — | CN | disclosed |
| WO-2005061682-A2 | LUBRICATING COMPOSITION CONTAINING METAL SALIXARATE AS DETERGENT | THE LUBRIZOL CORPORATION (US) | 2005-07-07 | — | — | WO | disclosed |