⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8436479 | 1.00 | — | — | |
| SCHEMBL8437396 | 0.94 | — | — | |
| SCHEMBL8441948 | 0.94 | — | — | |
| SCHEMBL8441372 | 0.94 | — | — | |
| SCHEMBL8436049 | 0.88 | MEN1 (0.31) | — | |
| SCHEMBL8439357 | 0.88 | MEN1 (0.31) | — | |
| SCHEMBL8437385 | 0.88 | — | — | |
| SCHEMBL8435880 | 0.88 | — | — | |
| SCHEMBL8439907 | 0.84 | — | — | |
| SCHEMBL8437409 | 0.83 | — | — |
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-5912374-A | Asymmetrical siloxy compounds | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1999-06-15 | — | — | US | disclosed |
| EP-0794187-A1 | Asymmetrical siloxy compounds | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1997-09-10 | — | — | EP | disclosed |