⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28891738 | 1.00 | — | — | |
| SCHEMBL6751597 | 1.00 | — | — | |
| SCHEMBL4429608 | 1.00 | — | — | |
| SCHEMBL1719882 | 1.00 | — | — | |
| SCHEMBL9108100 | 1.00 | — | — | |
| Fluoride SCHEMBL27533548 | 0.97 | — | — | |
| SCHEMBL969420 | 0.77 | — | — | |
| SCHEMBL2565575 | 0.76 | — | — | |
| SCHEMBL20494560 | 0.76 | — | — | |
| SCHEMBL2568120 | 0.76 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9000092-B2 | Rubber composition comprising a blocked mercaptosilane coupling agent | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2015-04-07 | — | — | US | disclosed |
| EP-2379633-B1 | RUBBER COMPOSITION COMPRISING A BLOCKED MERCAPTOSILANE COUPLING AGENT | MICHELIN & CIE (FR) | 2014-05-07 | — | — | EP | disclosed |
| US-20110306700-A1 | RUBBER COMPOSITION COMPRISING A BLOCKED MERCAPTOSILANE COUPLING AGENT | MICHELIN RECHERCHE ET TECHNIQUE S.A. (SE) | 2011-12-15 | — | — | US | disclosed |
| EP-2379633-A1 | RUBBER COMPOSITION COMPRISING A BLOCKED MERCAPTOSILANE COUPLING AGENT | Société de Technologie MICHELIN (FR) | 2011-10-26 | — | — | EP | disclosed |
| US-20110009547-A1 | RUBBER COMPOSITION FOR A TYRE COMPRISING A HYDROXYSILANE COVERING AGENT | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2011-01-13 | — | — | US | disclosed |
| EP-2212379-A2 | RUBBER COMPOSITION FOR A TYRE COMPRISING A HYDROXYSILANE COVERING AGENT | Société de Technologie MICHELIN (FR) | 2010-08-04 | — | — | EP | disclosed |
| WO-2010072682-A1 | RUBBER COMPOSITION COMPRISING A BLOCKED MERCAPTOSILANE COUPLING AGENT | SOCIETE DE TECHNOLOGIE MICHELIN (FR) | 2010-07-01 | — | — | WO | disclosed |
| WO-2009062733-A2 | RUBBER COMPOSITION FOR A TYRE COMPRISING A HYDROXYSILANE COVERING AGENT | SOCIETE DE TECHNOLOGIE MICHELIN (FR) | 2009-05-22 | — | — | WO | disclosed |