⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1129566 | 0.77 | — | — | |
| SCHEMBL51788 | 0.77 | — | — | |
| SCHEMBL14840328 | 0.77 | FDPS (0.48) | — | |
| SCHEMBL444804 | 0.77 | FDPS (0.42) | — | |
| SCHEMBL1272523 | 0.77 | — | — | |
| SCHEMBL3796003 | 0.77 | — | — | |
| SCHEMBL3421034 | 0.74 | — | — | |
| SCHEMBL27694522 | 0.74 | — | — | |
| SCHEMBL11442316 | 0.74 | — | — | |
| SCHEMBL6151052 | 0.72 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102686556-A | Opening of lactones and lactams | NOVARTIS AG | 2012-09-19 | — | — | CN | disclosed |
| CN-102260188-A | organic compounds | — | 2011-11-30 | — | — | CN | disclosed |
| CN-100509808-C | Novel thiazole derivates | HOFFMANN LA ROCHE (CH) | 2009-07-08 | — | — | CN | disclosed |
| CN-1890236-A | Novel thiazole derivates | HOFFMANN LA ROCHE (CH) | 2007-01-03 | — | — | CN | disclosed |
| CN-1882528-A | Organic compounds | NOVARTIS AG (CH) | 2006-12-20 | — | — | CN | disclosed |