⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL926530 | 0.83 | — | — | |
| SCHEMBL926529 | 0.83 | — | — | |
| SCHEMBL927327 | 0.74 | TDP1 (0.32) | — | |
| SCHEMBL927326 | 0.74 | TDP1 (0.32) | — | |
| SCHEMBL926690 | 0.65 | — | — | |
| SCHEMBL926691 | 0.65 | — | — | |
| SCHEMBL926692 | 0.60 | TDP1 (0.32) | — | |
| SCHEMBL28083315 | 0.60 | — | — | |
| SCHEMBL926693 | 0.60 | TDP1 (0.32) | — | |
| SCHEMBL3337761 | 0.59 | TRPA1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2207782-A2 | HALO-FUNCTIONAL SILANE, PROCESS FOR ITS PREPARATION, RUBBER COMPOSITION CONTAINING SAME AND ARTICLES MANUFACTURED THEREFROM | Momentive Performance Materials Inc. (US) | 2010-07-21 | — | — | EP | claimed |
| WO-2009058373-A2 | HALO-FUNCTIONAL SILANE, PROCESS FOR ITS PREPARATION, RUBBER COMPOSITION CONTAINING SAME AND ARTICLES MANUFACTURED THEREFROM | MOMENTIVE PERFORMANCE MATERIALS INC. (US) | 2009-05-07 | — | — | WO | claimed |