⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3292937 | 0.85 | CTSS (0.35) | — | |
| SCHEMBL816045 | 0.72 | TSHR (0.32) | — | |
| SCHEMBL3292713 | 0.72 | POLB (0.33) | — | |
| SCHEMBL3582066 | 0.72 | NOS3 (0.33) | — | |
| SCHEMBL3198834 | 0.71 | ALOX15 (0.45) | — | |
| SCHEMBL1908532 | 0.69 | POLB (0.46) | — | |
| SCHEMBL3289190 | 0.68 | NOS3 (0.31) | — | |
| SCHEMBL3296352 | 0.68 | KIF11 (0.31) | — | |
| SCHEMBL3290129 | 0.68 | — | — | |
| SCHEMBL3289169 | 0.67 | — | — |
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-7723384-B2 | Keto lactam compounds and use thereof | ABBOTT GMBH & CO. KG. (DE) | 2010-05-25 | — | — | US | disclosed |
| EP-1692129-B1 | KETO LACTAM COMPOUNDS AND USE THEREOF | ABBOTT GMBH & CO KG (DE) | 2008-08-20 | — | — | EP | disclosed |
| US-20070219182-A1 | Keto Lactam Compounds and Use Thereof | ABBVIE DEUTSCHLAND GMBH & CO KG (DE) | 2007-09-20 | — | — | US | disclosed |