⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1785020 | 0.78 | — | — | |
| SCHEMBL1785021 | 0.78 | — | — | |
| SCHEMBL13055451 | 0.73 | MGAM (0.39) | — | |
| SCHEMBL235434 | 0.72 | KDM4E (0.58) | — | |
| SCHEMBL2128645 | 0.71 | MGAM (0.56) | — | |
| SCHEMBL1608 | 0.71 | — | — | |
| SCHEMBL10389469 | 0.71 | MGAM (0.56) | — | |
| SCHEMBL1783850 | 0.71 | — | — | |
| SCHEMBL10936077 | 0.69 | KDM4E (0.55) | — | |
| SCHEMBL3519320 | 0.69 | KDM4E (0.55) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7618608-B1 | hydrolysis of tetraethoxysialnin presence of acetone with H2O produces Si(OH)4, by product methanol in acetone, aging to form gel (Si/OH/4 produces SiO2), silylating with hexamethyldisilazane, drying to form silica aerogel; byproduct of reaction is almost always alcohol with negligible amounts of water | KELLER COMPANIES, INC. (US) | 2009-11-17 | — | — | US | disclosed |