⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7702365 | 0.89 | — | — | |
| SCHEMBL7703137 | 0.89 | SMN1; SMN2 (0.40) | — | |
| SCHEMBL7699863 | 0.89 | — | — | |
| SCHEMBL7701152 | 0.89 | — | — | |
| SCHEMBL7706656 | 0.84 | SMN1; SMN2 (0.48) | — | |
| SCHEMBL7702930 | 0.84 | SMN1; SMN2 (0.41) | — | |
| SCHEMBL7704537 | 0.84 | SMN1; SMN2 (0.40) | — | |
| SCHEMBL7705898 | 0.84 | SMN1; SMN2 (0.40) | — | |
| SCHEMBL7702860 | 0.83 | MEN1 (0.45) | — | |
| SCHEMBL7698324 | 0.83 | MEN1 (0.45) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0901488-B1 | 2,4-DIAMINOPYRIMIDINE DERIVATIVES | BASILEA PHARMACEUTICA AG (CH) | 2002-11-06 | — | — | EP | disclosed |
| EP-0901488-A1 | 2,4-DIAMINOPYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1999-03-17 | — | — | EP | disclosed |
| WO-1997043277-A1 | 2,4-DIAMINOPYRIMIDINE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 1997-11-20 | — | — | WO | disclosed |