⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28221053 | 0.88 | — | — | |
| SCHEMBL27630890 | 0.67 | — | — | |
| SCHEMBL7631489 | 0.59 | — | — | |
| SCHEMBL21737153 | 0.53 | — | — | |
| SCHEMBL27949811 | 0.47 | — | — | |
| SCHEMBL28736746 | 0.47 | — | — | |
| SCHEMBL3628796 | 0.47 | LMNA (0.30) | — | |
| Scyllitol SCHEMBL188106 | 0.45 | LMNA (1.00) | — | |
| Scyllitol SCHEMBL188237 | 0.45 | LMNA (1.00) | — | |
| Scyllitol SCHEMBL4438767 | 0.45 | LMNA (1.00) | — |
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-5276166-A | Polyazetidinol containing materials | PPG INDUSTRIES, INC. (US) | 1994-01-04 | — | — | US | disclosed |
| WO-1993013063-A1 | POLYAZETIDINOL CONTAINING MATERIALS | PPG INDUSTRIES, INC. (US) | 1993-07-08 | — | — | WO | disclosed |