⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6965002 | 0.81 | — | — | |
| SCHEMBL13296266 | 0.73 | MGAM (0.50) | — | |
| SCHEMBL1120323 | 0.73 | MGAM (0.50) | — | |
| SCHEMBL14314040 | 0.73 | MGAM (0.50) | — | |
| SCHEMBL9448987 | 0.73 | MGAM (0.50) | — | |
| SCHEMBL4875428 | 0.73 | MGAM (0.50) | — | |
| SCHEMBL26657832 | 0.73 | MGAM (0.50) | — | |
| SCHEMBL9448983 | 0.73 | MGAM (0.50) | — | |
| Acetone SCHEMBL27953895 | 0.72 | MGAM (0.71) | — | |
| SCHEMBL53913 | 0.71 | — | — |
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-2007056468-A1 | METHODS FOR INHIBITING PROTEIN KINASES | SCHERING CORPORATION (US) | 2007-05-18 | — | — | WO | disclosed |