⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29346582 | 0.80 | — | — | |
| SCHEMBL29345872 | 0.80 | — | — | |
| SCHEMBL25646637 | 0.80 | — | — | |
| SCHEMBL25646623 | 0.74 | — | — | |
| SCHEMBL25672004 | 0.74 | — | — | |
| SCHEMBL25646625 | 0.70 | — | — | |
| SCHEMBL26751365 | 0.67 | — | — | |
| SCHEMBL24858551 | 0.65 | GAA (0.40) | — | |
| SCHEMBL30680861 | 0.65 | GAA (0.40) | — | |
| SCHEMBL24858616 | 0.65 | GAA (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117222650-A | Pyridine or pyrimido-ring compound, preparation method and medical application thereof | 劲方医药科技(上海)有限公司 | 2023-12-12 | — | — | CN | disclosed |
| WO-2018011160-A1 | 6,7-DIHYDRO-4H-PYRAZOLO[1,5-A]PYRAZINE COMPOUNDS FOR THE TREATMENT OF INFECTIOUS DISEASES | F. HOFFMANN-LA ROCHE AG (CH) | 2018-01-18 | — | — | WO | disclosed |