⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9210236 | 0.93 | — | — | |
| SCHEMBL5550232 | 0.85 | — | — | |
| SCHEMBL3346237 | 0.77 | — | — | |
| SCHEMBL1961412 | 0.77 | — | — | |
| SCHEMBL10391665 | 0.77 | — | — | |
| SCHEMBL9776337 | 0.77 | PDE8B (0.32) | — | |
| SCHEMBL254114 | 0.76 | KMT2A (0.33) | — | |
| SCHEMBL28846646 | 0.76 | — | — | |
| SCHEMBL5617622 | 0.74 | PDE8B (0.32) | — | |
| SCHEMBL13486887 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-107614501-B | Hydroxyl purine compound and application thereof | 广东众生睿创生物科技有限公司 | 2020-01-14 | — | — | CN | disclosed |