⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8404455 | 0.78 | — | — | |
| SCHEMBL4458196 | 0.76 | — | — | |
| SCHEMBL5634287 | 0.70 | — | — | |
| SCHEMBL1660318 | 0.70 | GABRR1 (0.36) | — | |
| SCHEMBL18332829 | 0.70 | PDPK1 (0.34) | — | |
| SCHEMBL5634577 | 0.65 | — | — | |
| SCHEMBL19409247 | 0.65 | — | — | |
| SCHEMBL5173516 | 0.64 | — | — | |
| SCHEMBL9576486 | 0.64 | SMN1; SMN2 (0.46) | — | |
| SCHEMBL19493860 | 0.64 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100210667-A1 | IMIDAZO [1, 2-C] PYRIMIDIN-2-YLMETHYLPIPERIDINES AS OREXIN RECEPTOR ANTAGONISTS | ALVARO GIUSEPPE | 2010-08-19 | — | — | US | disclosed |
| EP-2176265-A1 | IMIDAZO [1, 2-C]PYRIMIDIN-2-YLMETHYLPIPERIDINES AS OREXIN RECEPTOR ANTAGONISTS | Glaxo Group Limited (GB) | 2010-04-21 | — | — | EP | disclosed |
| WO-2009003997-A1 | IMIDAZO [1, 2-C] PYRIMIDIN-2-YLMETHYLPIPERIDINES AS OREXIN RECEPTOR ANTAGONISTS | GLAXO GROUP LIMITED (GB) | 2009-01-08 | — | — | WO | disclosed |