⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2075716 | 0.74 | HCAR2 (0.40) | — | |
| SCHEMBL1515388 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL2073751 | 0.69 | MAPK1 (0.32) | — | |
| SCHEMBL138455 | 0.67 | — | — | |
| SCHEMBL2075638 | 0.67 | LMNA (0.32) | — | |
| SCHEMBL27608726 | 0.67 | CTSK (0.33) | — | |
| SCHEMBL1644259 | 0.67 | TSHR (0.48) | — | |
| SCHEMBL12802738 | 0.66 | — | — | |
| SCHEMBL10117371 | 0.66 | TDP1 (0.50) | — | |
| SCHEMBL3617625 | 0.65 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100080786-A1 | Phenyl or Pyridinyl Substituted Indazoles Derivatives | ASTRAZENECA AB (SE) | 2010-04-01 | — | — | US | disclosed |