⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3768222 | 0.95 | — | — | |
| SCHEMBL3779063 | 0.95 | PAOX (0.32) | — | |
| SCHEMBL3768588 | 0.93 | PAOX (0.32) | — | |
| SCHEMBL3776716 | 0.89 | PAOX (0.31) | — | |
| SCHEMBL3768235 | 0.85 | — | — | |
| SCHEMBL3765415 | 0.83 | — | — | |
| SCHEMBL3768263 | 0.83 | — | — | |
| SCHEMBL3773056 | 0.82 | PAOX (0.31) | — | |
| SCHEMBL3777414 | 0.81 | — | — | |
| SCHEMBL3777591 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8436166-B2 | Amino-containing vinylsilane compounds and making method | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2013-05-07 | — | — | US | disclosed |
| US-20100317852-A1 | AMINO-CONTAINING VINYLSILANE COMPOUNDS AND MAKING METHOD | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2010-12-16 | — | — | US | disclosed |