⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12820958 | 0.77 | — | — | |
| SCHEMBL19681523 | 0.74 | — | — | |
| SCHEMBL2817476 | 0.73 | — | — | |
| SCHEMBL24797027 | 0.71 | — | — | |
| SCHEMBL14362851 | 0.71 | — | — | |
| SCHEMBL16771726 | 0.69 | — | — | |
| SCHEMBL1163765 | 0.69 | — | — | |
| Formic Acid SCHEMBL31006879 | 0.67 | — | — | |
| SCHEMBL14566834 | 0.67 | — | — | |
| SCHEMBL13460072 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9926303-B2 | Processes of synthesizing dihydropyridophthalazinone derivatives | MEDIVATION TECHNOLOGIES LLC (US) | 2018-03-27 | — | — | US | disclosed |