⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5658399 | 0.67 | — | — | |
| SCHEMBL29127577 | 0.65 | — | — | |
| SCHEMBL3979553 | 0.62 | — | — | |
| SCHEMBL4823439 | 0.62 | — | — | |
| SCHEMBL4457208 | 0.62 | — | — | |
| SCHEMBL20216837 | 0.61 | — | — | |
| SCHEMBL18660105 | 0.59 | — | — | |
| SCHEMBL6248941 | 0.58 | — | — | |
| SCHEMBL19231988 | 0.58 | — | — | |
| SCHEMBL6950043 | 0.57 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2009070583-A1 | PYRIDO[3,2-E]PYRAZINES, PROCESS FOR PREPARING THE SAME, AND THEIR USE AS INHIBITORS OF PHOSPHODIESTERASE 10 | WYETH (US) | 2009-06-04 | — | — | WO | disclosed |