⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10943602 | 0.72 | — | — | |
| SCHEMBL8062032 | 0.69 | — | — | |
| SCHEMBL8518166 | 0.67 | — | — | |
| SCHEMBL3432707 | 0.67 | — | — | |
| SCHEMBL3804318 | 0.65 | — | — | |
| SCHEMBL4779243 | 0.65 | — | — | |
| SCHEMBL9603578 | 0.65 | — | — | |
| SCHEMBL18918479 | 0.65 | — | — | |
| SCHEMBL7399124 | 0.64 | THRB (0.31) | — | |
| SCHEMBL571386 | 0.63 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5300641-A | Palladium black catalyzed process for preparation of (piperazinylorgano) silanes | DOW CORNING CORPORATION (US) | 1994-04-05 | — | — | US | disclosed |