⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23770818 | 0.81 | — | — | |
| SCHEMBL23770480 | 0.79 | GRIN2B (0.33) | — | |
| SCHEMBL19925168 | 0.78 | KIF18A (0.37) | — | |
| SCHEMBL23770812 | 0.77 | HSD11B1 (0.30) | — | |
| SCHEMBL23770787 | 0.73 | PDE10A (0.35) | — | |
| SCHEMBL23770416 | 0.73 | PTPN11 (0.37) | — | |
| SCHEMBL23770621 | 0.72 | PDE10A (0.35) | — | |
| SCHEMBL23770748 | 0.72 | RORC (0.33) | — | |
| SCHEMBL23770870 | 0.69 | DGAT1 (0.33) | — | |
| SCHEMBL23770649 | 0.69 | PIM1 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3504194-B1 | N-(PYRIDIN-2-YL)PYRIDINE-SULFONAMIDE DERIVATIVES AND THEIR USE IN THE TREATMENT OF DISEASE | NOVARTIS AG (CH) | 2021-08-18 | — | — | EP | disclosed |