⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15645880 | 0.86 | CYP2D6 (0.34) | — | |
| SCHEMBL20803462 | 0.83 | L3MBTL1 (0.32) | — | |
| SCHEMBL23323130 | 0.80 | — | — | |
| SCHEMBL5986542 | 0.78 | — | — | |
| SCHEMBL8356671 | 0.77 | CYP2D6 (0.31) | — | |
| SCHEMBL2668559 | 0.77 | CYP2D6 (0.31) | — | |
| SCHEMBL131689 | 0.75 | — | — | |
| SCHEMBL12695097 | 0.75 | CYP2D6 (0.34) | — | |
| SCHEMBL14486633 | 0.75 | CYP2D6 (0.34) | — | |
| SCHEMBL26167183 | 0.75 | — | — |
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-2009136850-A1 | MUSCARINIC RECEPTOR AGONITS USEFUL IN THE TREATMENT OF PAIN, ALZHEIMER'S DISEASE AND SCHIZOPHRENIA | ASTRAZENECA AB (SE) | 2009-11-12 | — | — | WO | disclosed |