⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11997386 | 0.74 | KDM4E (0.33) | — | |
| SCHEMBL31124103 | 0.74 | KDM4E (0.30) | — | |
| SCHEMBL31261123 | 0.74 | KDM4E (0.30) | — | |
| SCHEMBL7175270 | 0.73 | TDP1 (0.31) | — | |
| SCHEMBL31229282 | 0.69 | — | — | |
| SCHEMBL27938819 | 0.68 | — | — | |
| SCHEMBL10873900 | 0.67 | — | — | |
| SCHEMBL5048472 | 0.66 | — | — | |
| SCHEMBL29642086 | 0.66 | — | — | |
| SCHEMBL30569580 | 0.65 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2350072-A1 | SUBSTITUTED PYRAZOLOQUINOLINES AND DERIVATIVES THEREOF | Schering Corporation (US) | 2011-08-03 | — | — | EP | disclosed |
| WO-2010062559-A1 | SUBSTITUTED PYRAZOLOQUINOLINES AND DERIVATIVES THEREOF | SCHERING CORPORATION (US) | 2010-06-03 | — | — | WO | disclosed |