⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9024241 | 0.91 | MAPT (0.32) | — | |
| SCHEMBL9025305 | 0.88 | NQO2 (0.36) | — | |
| SCHEMBL9024634 | 0.86 | MAPT (0.32) | — | |
| SCHEMBL9024967 | 0.85 | ALDH1A1 (0.31) | — | |
| SCHEMBL9024632 | 0.85 | NQO1 (0.35) | — | |
| SCHEMBL9023982 | 0.79 | MAPT (0.36) | — | |
| SCHEMBL9023958 | 0.77 | TOP2A (0.42) | — | |
| SCHEMBL9024018 | 0.75 | NQO2 (0.38) | — | |
| SCHEMBL9023672 | 0.74 | G6PD (0.38) | — | |
| SCHEMBL9023862 | 0.74 | NQO2 (0.36) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0347749-B1 | Pyrazoloacridone derivatives with anti-tumoral activity | KYOWA HAKKO KOGYO KK (JP) | 1996-04-24 | — | — | EP | disclosed |
| US-5079358-A | Humans; leukemia | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1992-01-07 | — | — | US | disclosed |
| EP-0347749-A2 | Pyrazoloacridone derivatives with anti-tumoral activity | KYOWA HAKKO KOGYO CO., LTD. (JP) | 1989-12-27 | — | — | EP | disclosed |