⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4768091 | 0.91 | MAPT (0.31) | — | |
| SCHEMBL4766211 | 0.90 | — | — | |
| SCHEMBL4763286 | 0.90 | MAPT (0.31) | — | |
| SCHEMBL4769614 | 0.86 | PDE5A (0.31) | — | |
| SCHEMBL4769875 | 0.86 | — | — | |
| SCHEMBL4765572 | 0.85 | — | — | |
| SCHEMBL4762406 | 0.85 | PDE10A (0.32) | — | |
| SCHEMBL4769883 | 0.85 | — | — | |
| SCHEMBL4770139 | 0.85 | — | — | |
| SCHEMBL4767703 | 0.83 | PDE10A (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 |
|---|---|---|---|---|---|---|---|
| EP-1648899-B1 | IMIDAZO-PYRIMIDINES AND TRIAZOLO-PYRIMIDINES: BENZODIAZEPINE RECEPTOR LIGANDS | NEUROGEN CORP (US) | 2007-01-03 | — | — | EP | disclosed |