⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21798308 | 0.72 | — | — | |
| SCHEMBL21574360 | 0.71 | NLRP3 (0.36) | — | |
| SCHEMBL17803593 | 0.71 | — | — | |
| SCHEMBL28670667 | 0.67 | — | — | |
| SCHEMBL21801564 | 0.67 | — | — | |
| SCHEMBL22529460 | 0.67 | — | — | |
| SCHEMBL18269727 | 0.67 | — | — | |
| SCHEMBL21798142 | 0.66 | — | — | |
| SCHEMBL30009890 | 0.63 | JAK1 (0.34) | — | |
| SCHEMBL3920698 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3849979-A1 | ANTIVIRAL PYRIDOPYRAZINEDIONE COMPOUNDS | Novartis AG (CH) | 2021-07-21 | — | — | EP | disclosed |
| WO-2020053654-A1 | ANTIVIRAL PYRIDOPYRAZINEDIONE COMPOUNDS | NOVARTIS AG (CH) | 2020-03-19 | — | — | WO | disclosed |