⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2385806 | 0.74 | KDM4E (0.39) | — | |
| SCHEMBL208321 | 0.74 | — | — | |
| SCHEMBL5703136 | 0.72 | EPHX2 (0.31) | — | |
| SCHEMBL5703371 | 0.71 | EPHX2 (0.33) | — | |
| SCHEMBL5703241 | 0.71 | EPHX2 (0.31) | — | |
| SCHEMBL209610 | 0.70 | — | — | |
| SCHEMBL5703378 | 0.70 | — | — | |
| SCHEMBL3851050 | 0.67 | — | — | |
| SCHEMBL15023851 | 0.66 | — | — | |
| SCHEMBL56308 | 0.66 | KDM4E (0.39) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1456215-B1 | ORGANOSILICON COMPOUNDS, ELASTOMER COMPOSITIONS AND ARTICLES | RHODIA CHIMIE SA (FR) | 2006-08-09 | — | — | EP | disclosed |
| EP-1456215-A1 | ORGANOSILICON COMPOUNDS, ELASTOMER COMPOSITIONS AND ARTICLES | Rhodia Chimie (FR) | 2004-09-15 | — | — | EP | disclosed |
| WO-2003053983-A1 | ORGANOSILICON COMPOUNDS, ELASTOMER COMPOSITIONS AND ARTICLES | RHODIA CHIMIE (FR) | 2003-07-03 | — | — | WO | disclosed |