⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16919772 | 0.78 | CYP4F2 (0.31) | — | |
| SCHEMBL28080661 | 0.76 | — | — | |
| SCHEMBL11601652 | 0.76 | MEN1 (0.38) | — | |
| SCHEMBL6915244 | 0.76 | — | — | |
| SCHEMBL4874793 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL809243 | 0.73 | DGAT1 (0.40) | — | |
| SCHEMBL3687714 | 0.72 | CYP4F2 (0.41) | — | |
| SCHEMBL3740634 | 0.72 | FDPS (0.30) | — | |
| SCHEMBL13279073 | 0.72 | HMGCR (0.33) | — | |
| SCHEMBL28231305 | 0.72 | CYP4F2 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4824981-A | REACTING MALONATES WITH TRIALKYLSILANES, ALKALI METAL AND DIALKYLMALONIC ACID; PURITY | DOW CORNING CORPORATION (US) | 1989-04-25 | — | — | US | claimed |
| EP-0298363-B1 | A process to produce silyl ketene acetals | DOW CORNING (US) | 1993-12-01 | — | — | EP | disclosed |
| EP-0298363-A2 | A process to produce silyl ketene acetals | DOW CORNING CORPORATION (US) | 1989-01-11 | — | — | EP | disclosed |