⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5832519 | 0.87 | — | — | |
| SCHEMBL4537073 | 0.79 | — | — | |
| SCHEMBL4370012 | 0.70 | — | — | |
| SCHEMBL9158648 | 0.69 | ALDH1A1 (0.36) | — | |
| SCHEMBL11801830 | 0.57 | — | — | |
| SCHEMBL2416007 | 0.57 | — | — | |
| SCHEMBL30140506 | 0.56 | ALDH1A1 (0.36) | — | |
| SCHEMBL28302707 | 0.53 | — | — | |
| SCHEMBL20857005 | 0.52 | — | — | |
| SCHEMBL11231408 | 0.51 | — | — |
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-7030259-B2 | Process for the preparation of silicone compounds | DOW CORNING TORAY SILICONE CO., LTD. (JP) | 2006-04-18 | — | — | US | disclosed |
| US-20050256330-A1 | Process for the preparation of silicone compounds | DOW TORAY CO., LTD. (JP) | 2005-11-17 | — | — | US | disclosed |
| EP-1472264-B1 | PROCESSES FOR THE PREPARATION OF SILICONE COMPOUNDS | DOW CORNING TORAY SILICONE (JP) | 2005-06-15 | — | — | EP | disclosed |
| EP-1472264-A1 | PROCESSES FOR THE PREPARATION OF SILICONE COMPOUNDS | Dow Corning Toray Silicone Co., Ltd. (JP) | 2004-11-03 | — | — | EP | disclosed |
| WO-2003064436-A1 | PROCESSES FOR THE PREPARATION OF SILICONE COMPOUNDS | DOW CORNING TORAY SILICONE CO., LTD. (JP) | 2003-08-07 | — | — | WO | disclosed |