⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30731364 | 0.65 | ALDH1A1 (0.32) | — | |
| SCHEMBL4913305 | 0.62 | — | — | |
| SCHEMBL7338785 | 0.61 | GSK3A (0.43) | — | |
| SCHEMBL765239 | 0.59 | — | — | |
| SCHEMBL943110 | 0.58 | GSK3A (0.46) | — | |
| SCHEMBL2496538 | 0.58 | — | — | |
| SCHEMBL13884463 | 0.55 | — | — | |
| SCHEMBL6027741 | 0.55 | ALDH1A1 (0.47) | — | |
| SCHEMBL5728992 | 0.55 | TRIM24 (0.50) | — | |
| SCHEMBL4840007 | 0.54 | TRIM24 (0.43) | — |
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-4511569-A | Tricyclic lactams and derivatives useful in increasing cardiac contractility | SCHERING CORPORATION (US) | 1985-04-16 | — | — | US | disclosed |