⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12518995 | 0.73 | — | — | |
| SCHEMBL3424626 | 0.73 | — | — | |
| SCHEMBL6433650 | 0.73 | — | — | |
| Dianhydrogalactitol SCHEMBL4307933 | 0.73 | THRB (0.30) | — | |
| Dianhydrogalactitol SCHEMBL8375579 | 0.73 | THRB (0.30) | — | |
| Dianhydrogalactitol SCHEMBL15496475 | 0.73 | THRB (0.30) | — | |
| Dianhydrogalactitol SCHEMBL16387832 | 0.73 | THRB (0.30) | — | |
| Dianhydrogalactitol SCHEMBL4306431 | 0.73 | THRB (0.30) | — | |
| Dianhydrogalactitol SCHEMBL17264073 | 0.73 | THRB (0.30) | — | |
| Dianhydrogalactitol SCHEMBL21761430 | 0.73 | THRB (0.30) | — |
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-1259565-B1 | SILICA REINFORCED RUBBER COMPOSITIONS OF IMPROVED PROCESSABILITY AND STORAGE STABILITY | PIRELLI (IT) | 2008-11-26 | — | — | EP | disclosed |