⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12223314 | 0.80 | PIK3CD (0.33) | — | |
| SCHEMBL10238457 | 0.77 | — | — | |
| SCHEMBL21279251 | 0.77 | — | — | |
| SCHEMBL17719320 | 0.77 | — | — | |
| SCHEMBL18850882 | 0.77 | — | — | |
| SCHEMBL12439788 | 0.75 | — | — | |
| SCHEMBL6933375 | 0.75 | — | — | |
| SCHEMBL16592200 | 0.75 | — | — | |
| SCHEMBL18118504 | 0.70 | PIK3CD (0.38) | — | |
| SCHEMBL3315860 | 0.70 | KDM4E (0.33) | — |
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-2010049731-A1 | PYRAZOLO- AND IMIDAZOPYRIDINYLPYRIMIDINEAMINES AS IGF-1R TYROSINE KINASE INHIBITORS | ASTRAZENECA AB (SE) | 2010-05-06 | — | — | WO | disclosed |
| US-20100105655-A1 | NOVEL COMPOUNDS 515 | ASTRAZENECA AB | 2010-04-29 | — | — | US | disclosed |