⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9059398 | 0.93 | MEN1 (0.58) | — | |
| Sulfuric Acid SCHEMBL11565555 | 0.90 | GRIN2D (0.53) | — | |
| Sulfuric Acid SCHEMBL11565557 | 0.90 | GRIN2D (0.53) | — | |
| SCHEMBL23743149 | 0.85 | — | — | |
| Sulfuric Acid SCHEMBL11558128 | 0.84 | MEN1 (0.48) | — | |
| Sulfuric Acid SCHEMBL11558130 | 0.84 | MEN1 (0.48) | — | |
| Sulfuric Acid SCHEMBL11562058 | 0.82 | MEN1 (0.52) | — | |
| Sulfuric Acid SCHEMBL11560824 | 0.82 | MEN1 (0.52) | — | |
| Sulfuric Acid SCHEMBL11560826 | 0.82 | MEN1 (0.52) | — | |
| Sulfuric Acid SCHEMBL11562055 | 0.82 | MEN1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0030835-B1 | DERIVATIVES OF 2-SUBSTITUTED-6-PHENYL-3(2H)PYRIDAZINONE, THEIR PRODUCTION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | MORISHITA PHARMACEUTICAL CO. LTD. (JP) | 1983-05-11 | — | — | EP | disclosed |