⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1892675 | 0.72 | — | — | |
| SCHEMBL14513786 | 0.72 | — | — | |
| SCHEMBL778969 | 0.69 | — | — | |
| SCHEMBL597380 | 0.69 | — | — | |
| SCHEMBL1093726 | 0.67 | — | — | |
| SCHEMBL13173433 | 0.67 | — | — | |
| SCHEMBL1892678 | 0.67 | — | — | |
| SCHEMBL31694404 | 0.67 | — | — | |
| SCHEMBL3745325 | 0.67 | — | — | |
| SCHEMBL8144999 | 0.67 | USP2 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005020987-A1 | HETEROCYCLIC AMIDE DERIVATIVES WHICH POSSES GLYCOGEN PHOSPHORYLASE INHIBITORY ACTIVITY | ASTRAZENECA AB (SE) | 2005-03-10 | — | — | WO | disclosed |