⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15448059 | 0.81 | ALDH1A1 (0.35) | — | |
| SCHEMBL7769045 | 0.81 | ALDH1A1 (0.35) | — | |
| SCHEMBL7769047 | 0.81 | ALDH1A1 (0.35) | — | |
| SCHEMBL27927426 | 0.78 | — | — | |
| SCHEMBL11579062 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL11579059 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL563836 | 0.75 | — | — | |
| SCHEMBL13703335 | 0.74 | — | — | |
| SCHEMBL7750753 | 0.74 | — | — | |
| SCHEMBL9476869 | 0.74 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117258803-A | Mesoporous cerium oxide loaded PdCu nanoparticle catalyst and preparation method and application thereof | 包头稀土研究院 | 2023-12-22 | — | — | CN | disclosed |
| CN-114249629-B | Method for synthesizing enol by selective catalytic hydrogenation of alkynol | 兰州大学 | 2023-05-26 | — | — | CN | disclosed |
| EP-1687358-B1 | CARBINOL-FUNCTIONAL SILICONE RESINS | DOW CORNING (US) | 2011-06-22 | — | — | EP | disclosed |
| US-7858697-B2 | Carbinol functional silicone resins | DOW CORNING CORPORATION (US) | 2010-12-28 | — | — | US | disclosed |
| CN-100419001-C | Carbinol functional silicone resins | DOW CORNING (US) | 2008-09-17 | — | — | CN | disclosed |
| CN-1863843-A | Carbinol functional silicone resins | DOW CORNING (US) | 2006-11-15 | — | — | CN | disclosed |
| US-20060235142-A1 | Carbinol functional silicone resins | DOW CORNING CORPORATION | 2006-10-19 | — | — | US | disclosed |
| EP-1687358-A1 | CARBINOL-FUNCTION SILICINE RESINS | Dow Corning Corporation (US) | 2006-08-09 | — | — | EP | disclosed |
| WO-2005037891-A1 | CARBINOL-FUNCTION SILICINE RESINS | DOW CORNING CORPORATION (US) | 2005-04-28 | — | — | WO | disclosed |
| US-6297331-B1 | ETHYL HYDROXYALKYL ETHER ATTACHED VIA CARBON TO SILICON, INTERMEDIATES FOR THE PREPARATION OF SILICONE POLYETHERS, POLYESTERS, POLYURETHANES, ACRYLATES AND SILICONE ISOCYANATES. DIRT-REPELLENT COATINGS. ANTI-GRAFFITI | TH. GOLDSCHMIDT AG (DE) | 2001-10-02 | — | — | US | disclosed |