⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14645640 | 1.00 | — | — | |
| SCHEMBL16154019 | 1.00 | — | — | |
| SCHEMBL2567991 | 1.00 | — | — | |
| SCHEMBL16793282 | 1.00 | — | — | |
| SCHEMBL9233111 | 1.00 | — | — | |
| SCHEMBL3804333 | 0.94 | — | — | |
| SCHEMBL707236 | 0.94 | — | — | |
| SCHEMBL400341 | 0.80 | — | — | |
| SCHEMBL25173757 | 0.78 | TSHR (0.44) | — | |
| SCHEMBL15965319 | 0.78 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3995320-A1 | ENERGY-EFFICIENT SOLVENT-FREE PROCESS FOR ORGANOSILANIZATION OF SILICATE AND SILICON DIOXIDE MATERIALS | Continental Reifen Deutschland GmbH (DE) | 2022-05-11 | — | — | EP | disclosed |
| US-6927244-B2 | Comprises diene-ethylene-propylene copolymer mixed with sulfur-containing/mercapto-based silane coupling agent to reduce stiffness | TOKAI RUBBER INDUSTRIES, LTD. (JP) | 2005-08-09 | — | — | US | disclosed |
| EP-1448570-A1 | PROCESS FOR PREPARING SILYLORGANOMERCAPTANS | GENERAL ELECTRIC COMPANY (US) | 2004-08-25 | — | — | EP | disclosed |
| WO-2003040153-A1 | PROCESS FOR PREPARING SILYLORGANOMERCAPTANS | GENERAL ELECTRIC COMPANY (US) | 2003-05-15 | — | — | WO | disclosed |