⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4558564 | 0.89 | — | — | |
| SCHEMBL1343997 | 0.85 | MAPT (0.33) | — | |
| SCHEMBL1343048 | 0.83 | MAPT (0.34) | — | |
| SCHEMBL1342978 | 0.80 | MAPT (0.32) | — | |
| SCHEMBL1341352 | 0.80 | GCK (0.32) | — | |
| SCHEMBL4558523 | 0.79 | GCK (0.32) | — | |
| SCHEMBL1342521 | 0.78 | NPC1 (0.38) | — | |
| SCHEMBL1342996 | 0.78 | MAPT (0.37) | — | |
| SCHEMBL4558289 | 0.78 | GCK (0.31) | — | |
| SCHEMBL1341082 | 0.78 | RORC (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7541373-B2 | Aryl carbonyl derivatives as therapeutic agents | NOVO NORDISK A/S (DK) | 2009-06-02 | — | — | US | disclosed |
| US-20080119454-A1 | Aryl carbonyl derivatives as therapeutic agents | NOVO NORDISK A/S (DK) | 2008-05-22 | — | — | US | disclosed |
| US-20080119455-A1 | Aryl carbonyl derivatives as therapeutic agents | NOVO NORDISK A/S (DK) | 2008-05-22 | — | — | US | disclosed |
| US-20060183783-A1 | Aryl carbonyl derivatives as therapeutic agents | VTV THERAPEUTICS LLC | 2006-08-17 | — | — | US | disclosed |