⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4076540 | 0.82 | L3MBTL1 (0.42) | — | |
| SCHEMBL13411343 | 0.76 | — | — | |
| SCHEMBL564890 | 0.71 | — | — | |
| SCHEMBL2491280 | 0.71 | — | — | |
| SCHEMBL12143122 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL5574787 | 0.70 | KMT2A (0.47) | — | |
| SCHEMBL10234017 | 0.68 | JAK3 (0.34) | — | |
| SCHEMBL15777833 | 0.67 | CHEK1 (0.42) | — | |
| SCHEMBL21767967 | 0.67 | CA2 (0.55) | — | |
| SCHEMBL9685860 | 0.67 | CYP2C19 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2019141957-A1 | N-PYRIMIDINYL HYDROXY PYRAZOLE DERIVATIVES AND USES THEREOF | CADO BIOTECHNOLOGY IVS (DK) | 2019-07-25 | — | — | WO | disclosed |
| US-8202876-B2 | Compounds and compositions as protein kinase inhibitors | IRM LLC (BM) | 2012-06-19 | — | — | US | disclosed |
| US-20100029605-A1 | COMPOUNDS AND COMPOSITIONS AS PROTEIN KINASE INHIBITORS | IRM LLC (BM) | 2010-02-04 | — | — | US | disclosed |