⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4054090 | 0.79 | — | — | |
| SCHEMBL15782173 | 0.74 | — | — | |
| SCHEMBL961615 | 0.74 | — | — | |
| SCHEMBL6586160 | 0.69 | — | — | |
| SCHEMBL17898497 | 0.69 | POLB (0.41) | — | |
| SCHEMBL3811251 | 0.67 | MEN1 (0.41) | — | |
| SCHEMBL10934409 | 0.67 | — | — | |
| SCHEMBL19072070 | 0.67 | MCL1 (0.45) | — | |
| Nitroacetic Acid SCHEMBL153563 | 0.65 | — | — | |
| SCHEMBL9683823 | 0.63 | MEN1 (0.44) | — |
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-2004060890-A1 | 2-OXOPYRIDIN-3-YL THIA (DI) AZOLE DERIVATES FOR USE IN THE TREATMENT OF CELL PROLIFERATION AND APOPTOSIS RELATED DISEASES | AMGEN INC. (US) | 2004-07-22 | — | — | WO | disclosed |