⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12465810 | 0.72 | — | — | |
| SCHEMBL6125673 | 0.63 | — | — | |
| SCHEMBL21798657 | 0.63 | — | — | |
| SCHEMBL6125672 | 0.63 | — | — | |
| SCHEMBL23144602 | 0.61 | — | — | |
| SCHEMBL5197844 | 0.59 | — | — | |
| SCHEMBL25568534 | 0.54 | PRMT1 (0.32) | — | |
| SCHEMBL25568558 | 0.54 | PRMT1 (0.32) | — | |
| SCHEMBL28954718 | 0.52 | — | — | |
| SCHEMBL24424227 | 0.52 | — | — |
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-2459535-A1 | PYRIDINE AND PYRAZINE DERIVATIVES AS PROTEIN KINASE MODULATORS | Novartis AG (CH) | 2012-06-06 | — | — | EP | disclosed |
| WO-2011012661-A1 | PYRIDINE AND PYRAZINE DERIVATIVES AS PROTEIN KINASE MODULATORS | NOVARTIS AG (CH) | 2011-02-03 | — | — | WO | disclosed |