⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL482353 | 0.70 | — | — | |
| SCHEMBL9677469 | 0.67 | — | — | |
| SCHEMBL2503096 | 0.65 | — | — | |
| SCHEMBL496830 | 0.65 | — | — | |
| SCHEMBL11810865 | 0.64 | ABCG2 (0.34) | — | |
| SCHEMBL2863306 | 0.64 | — | — | |
| SCHEMBL17749950 | 0.62 | — | — | |
| SCHEMBL14877178 | 0.61 | — | — | |
| SCHEMBL3803924 | 0.60 | — | — | |
| SCHEMBL2813723 | 0.58 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11970448-B2 | Monomers capable of dimerizing in an aqueous solution, and methods of using same | CORNELL UNIVERSITY (US) | 2024-04-30 | — | — | US | disclosed |
| US-20200354319-A1 | MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME | UNIV CORNELL (US) | 2020-11-12 | — | — | US | disclosed |
| US-20140194383-A1 | MONOMERS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME | CORNELL UNIVERSITY (US) | 2014-07-10 | — | — | US | disclosed |
| US-8569518-B2 | Bicyclic dioxanes, their preparation and their use as fragrant compounds | V. MANE FILS (FR) | 2013-10-29 | — | — | US | disclosed |
| US-20120165557-A1 | New Bicyclic Dioxanes, Their Preparation and Their Use as Fragrant Compounds | V. MANE FILS (FR) | 2012-06-28 | — | — | US | disclosed |