⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22147390 | 0.79 | — | — | |
| SCHEMBL18622399 | 0.74 | MAPK1 (0.31) | — | |
| SCHEMBL10138227 | 0.74 | MAPK1 (0.31) | — | |
| SCHEMBL13656193 | 0.74 | MAPK1 (0.31) | — | |
| SCHEMBL14217144 | 0.74 | MAPK1 (0.31) | — | |
| SCHEMBL23098524 | 0.72 | — | — | |
| SCHEMBL13741059 | 0.70 | — | — | |
| SCHEMBL12766260 | 0.69 | — | — | |
| SCHEMBL19430774 | 0.69 | MAPK1 (0.37) | — | |
| SCHEMBL13656192 | 0.69 | TSHR (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7605176-B2 | β-ketoamide compounds with MCH antagonistic activity | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2009-10-20 | — | — | US | disclosed |