⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6449269 | 0.80 | — | — | |
| SCHEMBL1836382 | 0.69 | DNMT1 (0.41) | — | |
| SCHEMBL21626846 | 0.69 | TET2 (0.31) | — | |
| SCHEMBL13351590 | 0.67 | HASPIN (0.30) | — | |
| SCHEMBL8845705 | 0.66 | PNP (0.44) | — | |
| SCHEMBL27543213 | 0.66 | TYMP (0.48) | — | |
| Tromethamine SCHEMBL9736256 | 0.65 | ALB (0.31) | — | |
| SCHEMBL9124228 | 0.65 | — | — | |
| SCHEMBL17124968 | 0.64 | MITF (0.44) | — | |
| SCHEMBL12870924 | 0.64 | KMT2A (0.37) | — |
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-1491111-A | Antiviral method of use | — | 2004-04-21 | — | — | CN | disclosed |