⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12344479 | 0.79 | — | — | |
| SCHEMBL8011007 | 0.77 | — | — | |
| SCHEMBL13384272 | 0.74 | KDM4E (0.36) | — | |
| SCHEMBL3323880 | 0.69 | — | — | |
| SCHEMBL10964790 | 0.69 | — | — | |
| SCHEMBL18212638 | 0.65 | — | — | |
| SCHEMBL19159133 | 0.65 | — | — | |
| SCHEMBL22031231 | 0.64 | RET (0.39) | — | |
| SCHEMBL15548863 | 0.64 | — | — | |
| SCHEMBL3033643 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9315521-B2 | Pyrimidines as novel therapeutic agents | UNIVERSITé LAVAL (CA) | 2016-04-19 | — | — | US | disclosed |
| US-9315521-B2 | Pyrimidines as novel therapeutic agents | UNIVERSITé LAVAL (CA) | 2016-04-19 | — | — | US | disclosed |