⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30992090 | 0.94 | — | — | |
| SCHEMBL30991935 | 0.82 | — | — | |
| SCHEMBL30991928 | 0.78 | — | — | |
| SCHEMBL22996563 | 0.68 | TSHR (0.34) | — | |
| SCHEMBL11951041 | 0.64 | SRD5A1 (0.32) | — | |
| SCHEMBL22170919 | 0.64 | POLA1 (0.33) | — | |
| SCHEMBL24132295 | 0.64 | — | — | |
| SCHEMBL17292948 | 0.62 | PDE10A (0.33) | — | |
| SCHEMBL8566538 | 0.61 | — | — | |
| SCHEMBL2406607 | 0.61 | HTR2B (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024151112-A1 | PYRAZOLOPYRIMIDINE DERIVATIVE AS CYCLIN-DEPENDENT KINASE 9 INHIBITOR | 주식회사 티움바이오 | 2024-07-18 | — | — | WO | claimed |
| WO-2024151112-A1 | PYRAZOLOPYRIMIDINE DERIVATIVE AS CYCLIN-DEPENDENT KINASE 9 INHIBITOR | 주식회사 티움바이오 | 2024-07-18 | — | — | WO | disclosed |