⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6191710 | 0.74 | MEN1 (0.61) | — | |
| SCHEMBL2657846 | 0.73 | — | — | |
| SCHEMBL2111705 | 0.71 | — | — | |
| SCHEMBL4028237 | 0.71 | — | — | |
| SCHEMBL6656197 | 0.71 | MEN1 (0.41) | — | |
| SCHEMBL23143621 | 0.71 | — | — | |
| SCHEMBL4028303 | 0.71 | — | — | |
| SCHEMBL12224195 | 0.71 | — | — | |
| SCHEMBL13729494 | 0.70 | MEN1 (0.47) | — | |
| SCHEMBL28505087 | 0.70 | MEN1 (0.40) | — |
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-2124954-A2 | PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES | IRM LLC (BM) | 2009-12-02 | — | — | EP | disclosed |
| WO-2008094737-A2 | PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES | IRM LLC (BM) | 2008-08-07 | — | — | WO | disclosed |