⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12333884 | 0.61 | PIK3CD (0.47) | — | |
| SCHEMBL654484 | 0.60 | PI4KA (0.57) | — | |
| SCHEMBL18295685 | 0.58 | ADORA3 (0.43) | — | |
| SCHEMBL16013803 | 0.58 | ADORA3 (0.47) | — | |
| SCHEMBL16012997 | 0.57 | MKNK1 (0.47) | — | |
| SCHEMBL10371315 | 0.57 | PIK3CD (0.51) | — | |
| SCHEMBL1754158 | 0.56 | HDAC6 (0.34) | — | |
| SCHEMBL12930105 | 0.56 | IKBKB (0.36) | — | |
| SCHEMBL8823861 | 0.54 | — | — | |
| SCHEMBL15296466 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7427616-B2 | Condensed pyridines and pyrimidines with tie2 (TEK) activity | ASTRAZENECA AB (SE) | 2008-09-23 | — | — | US | disclosed |
| EP-1537112-B1 | CONDENSED PYRIDINES AND PYRIMIDINES WITH TIE2 (TEK) ACTIVITY | ASTRAZENECA AB (SE) | 2006-04-19 | — | — | EP | disclosed |
| US-20050256140-A1 | Condensed pyridines and pyrimidines with tie2 (tek) activity | ASTRAZENECA AB (SE) | 2005-11-17 | — | — | US | disclosed |