⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL986986 | 0.85 | — | — | |
| SCHEMBL728050 | 0.78 | NAAA (0.31) | — | |
| SCHEMBL15157926 | 0.77 | — | — | |
| SCHEMBL17272687 | 0.74 | NAAA (0.31) | — | |
| SCHEMBL17272668 | 0.74 | NAAA (0.31) | — | |
| SCHEMBL407181 | 0.73 | — | — | |
| SCHEMBL28916639 | 0.73 | NAAA (0.34) | — | |
| SCHEMBL3481443 | 0.73 | ADRB2 (0.33) | — | |
| SCHEMBL10815832 | 0.72 | TSHR (0.33) | — | |
| SCHEMBL3671956 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017093759-A1 | FUNCTIONALISATION METHOD FOR METAL OXIDE PARTICLES | THE WELDING INSTITUTE (GB) | 2017-06-08 | — | — | WO | disclosed |
| US-7910216-B2 | Process for the production of organosilsesquioxanes | THE WELDING INSTITUTE (GB) | 2011-03-22 | — | — | US | disclosed |
| US-20070122636-A1 | PROCESS FOR THE PRODUCTION OF ORGANOSILSESQUIOXANES | THE WELDING INSTITUTE (GB) | 2007-05-31 | — | — | US | disclosed |
| US-20040039094-A1 | Coating compositions | WELDING INSTITUTE, THE (GB) | 2004-02-26 | — | — | US | disclosed |