⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1445541 | 0.73 | — | — | |
| SCHEMBL5229791 | 0.71 | — | — | |
| SCHEMBL23617843 | 0.70 | — | — | |
| SCHEMBL23617652 | 0.67 | ALDH1A1 (0.43) | — | |
| Sulfuric Acid SCHEMBL11750077 | 0.64 | KDM4E (0.38) | — | |
| SCHEMBL41866 | 0.63 | — | — | |
| SCHEMBL23617445 | 0.62 | CA1 (0.31) | — | |
| SCHEMBL13608755 | 0.62 | ALDH1A1 (0.48) | — | |
| SCHEMBL11216253 | 0.61 | — | — | |
| SCHEMBL30568037 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-8324204-B2 | Fused thiophene derivatives as kinase inhibitors | UCB PHARMA SA (BE) | 2012-12-04 | — | — | US | disclosed |
| US-20100305066-A1 | Fused Thiophene Derivatives as Kinase Inhibitors | UCB PHARMA S.A. (BE) | 2010-12-02 | — | — | US | disclosed |