⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12677627 | 0.77 | — | — | |
| SCHEMBL11217211 | 0.74 | — | — | |
| SCHEMBL5468649 | 0.74 | — | — | |
| SCHEMBL4277218 | 0.74 | — | — | |
| SCHEMBL14087111 | 0.74 | — | — | |
| SCHEMBL375354 | 0.72 | — | — | |
| SCHEMBL2452779 | 0.71 | — | — | |
| SCHEMBL8751638 | 0.70 | MAPK1 (0.33) | — | |
| SCHEMBL1538055 | 0.69 | — | — | |
| SCHEMBL732311 | 0.69 | MAPK1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109415390-B | Rubber composition containing monohydroxysilane polysulfide coupling agent | 米其林集团总公司 | 2021-06-01 | — | — | CN | disclosed |
| US-10961371-B2 | Rubber composition comprising a monohydroxysilane polysulfide coupling agent | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2021-03-30 | — | — | US | disclosed |
| US-20190233618-A1 | RUBBER COMPOSITION COMPRISING A MONOHYDROXYSILANE POLYSULFIDE COUPLING AGENT | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2019-08-01 | — | — | US | disclosed |
| EP-3478695-A1 | MONOHYDROXYSILANE POLYSULFIDE | Compagnie Générale des Etablissements Michelin (FR) | 2019-05-08 | — | — | EP | disclosed |