⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10236668 | 0.85 | — | — | |
| SCHEMBL10236601 | 0.84 | — | — | |
| SCHEMBL10236441 | 0.84 | PTPN1 (0.39) | — | |
| SCHEMBL10236669 | 0.83 | — | — | |
| SCHEMBL10236833 | 0.82 | — | — | |
| SCHEMBL10236828 | 0.81 | — | — | |
| SCHEMBL10279154 | 0.80 | MEN1 (0.43) | — | |
| SCHEMBL10236672 | 0.79 | PTPN1 (0.38) | — | |
| SCHEMBL10236835 | 0.79 | MEN1 (0.41) | — | |
| SCHEMBL10236674 | 0.78 | PTPN1 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010101967-A2 | PHOSPHOTHIOPHENE AND PHOSPHOTHIAZOLE HCV POLYMERASE INHIBITORS | IDENIX PHARMACEUTICALS, INC. (US) | 2010-09-10 | — | — | WO | disclosed |