⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23009433 | 0.74 | — | — | |
| SCHEMBL21238781 | 0.74 | — | — | |
| SCHEMBL12405146 | 0.69 | — | — | |
| SCHEMBL1227242 | 0.69 | — | — | |
| SCHEMBL12405136 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL1227799 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL1226098 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL1226096 | 0.68 | — | — | |
| SCHEMBL1555859 | 0.67 | GRIN1 (0.32) | — | |
| SCHEMBL2476689 | 0.65 | GRIN1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7998959-B2 | Modulators of 11-β hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same | INCYTE CORPORATION (US) | 2011-08-16 | — | — | US | disclosed |
| US-20070197506-A1 | Modulators of 11-beta hydroxyl steroid dehydrogenase type 1, pharmaceutical compositions thereof, and methods of using the same | INCYTE CORPORATION | 2007-08-23 | — | — | US | disclosed |