⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL74466 | 0.73 | — | — | |
| SCHEMBL3879930 | 0.73 | — | — | |
| SCHEMBL18432760 | 0.73 | ANPEP (0.30) | — | |
| SCHEMBL58748 | 0.71 | GRM4 (0.45) | — | |
| SCHEMBL23891998 | 0.71 | — | — | |
| SCHEMBL21306227 | 0.71 | — | — | |
| SCHEMBL162368 | 0.69 | GGT1 (0.52) | — | |
| SCHEMBL243496 | 0.69 | GGT1 (0.52) | — | |
| SCHEMBL11192504 | 0.69 | NOS1 (0.33) | — | |
| SCHEMBL5614525 | 0.69 | GGT1 (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 |
|---|---|---|---|---|---|---|---|
| US-20210115444-A1 | CHIRAL DESIGN | WAVE LIFE SCIENCES LTD. (SG) | 2021-04-22 | — | — | US | disclosed |
| EP-3253758-B1 | N-SUBSTITUTED 8-[(2,6-DIFLUOROBENZYL)OXY]-2,6-DIMETHYLIMIDAZO[1,2-A]PYRAZINE-3-CARBOXAMIDE-DERIVATIVES AS STIMULATORS OF THE SOLUBLE GUANYLATCYCLASE (SGC) FOR THE TREATMENT OF CARDIOVASCULAR DISEASES | Bayer Pharma AG (DE) | 2019-04-03 | — | — | EP | disclosed |