⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL466789 | 0.91 | — | — | |
| SCHEMBL467084 | 0.85 | — | — | |
| SCHEMBL466820 | 0.84 | — | — | |
| SCHEMBL466919 | 0.84 | — | — | |
| SCHEMBL467068 | 0.84 | — | — | |
| SCHEMBL466901 | 0.84 | — | — | |
| SCHEMBL466602 | 0.84 | — | — | |
| SCHEMBL16761011 | 0.83 | — | — | |
| SCHEMBL17837319 | 0.81 | — | — | |
| SCHEMBL4439647 | 0.80 | — | — |
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-1157146-B1 | SILANE COATINGS FOR BONDING RUBBER TO METALS | UNIV CINCINNATI (US) | 2003-10-22 | — | — | EP | claimed |
| EP-1198616-A1 | ACYLOXY SILANE TREATMENTS FOR METALS | THE UNIVERSITY OF CINCINNATI (US) | 2002-04-24 | — | — | EP | disclosed |
| WO-2001006036-A1 | ACYLOXY SILANE TREATMENTS FOR METALS | UNIVERSITY OF CINCINNATI (GB) | 2001-01-25 | — | — | WO | disclosed |