⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7305027 | 0.78 | NPC1 (0.30) | — | |
| SCHEMBL7303101 | 0.71 | MAPT (0.31) | — | |
| SCHEMBL7304154 | 0.62 | BACE1 (0.35) | — | |
| SCHEMBL22529449 | 0.62 | MAPK1 (0.54) | — | |
| SCHEMBL7307619 | 0.58 | RAB9A (0.34) | — | |
| SCHEMBL10377637 | 0.53 | ALDH1A1 (0.36) | — | |
| SCHEMBL7307200 | 0.52 | ACHE (0.31) | — | |
| SCHEMBL17008811 | 0.52 | PTGER4 (0.31) | — | |
| SCHEMBL3466683 | 0.51 | — | — | |
| SCHEMBL23794890 | 0.51 | GAA (0.46) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0556008-B1 | Condensed imidazopyridine derivatives with psychotropic activity | SHIONOGI & CO (JP) | 1997-05-14 | — | — | EP | disclosed |
| US-5461062-A | Psychotropic agent as antianxiety agent, anesthesia antagonistic agent | SHIONOGI & CO., LTD. (JP) | 1995-10-24 | — | — | US | disclosed |
| US-5378848-A | Benzodiazepine agonist, psychotropic, antianxiety, cerebral function activator, anesthesia atagonist | SHIONOGI & CO., LTD. (JP) | 1995-01-03 | — | — | US | disclosed |
| EP-0556008-A1 | Condensed imidazopyridine derivatives with psychotropic activity | SHIONOGI & CO., LTD. (JP) | 1993-08-18 | — | — | EP | disclosed |