⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10644612 | 0.79 | — | — | |
| SCHEMBL27089533 | 0.76 | — | — | |
| SCHEMBL1282563 | 0.75 | — | — | |
| SCHEMBL841621 | 0.74 | — | — | |
| SCHEMBL839806 | 0.70 | — | — | |
| SCHEMBL16588061 | 0.69 | CTSK (0.38) | — | |
| SCHEMBL29773797 | 0.68 | FFAR3 (0.41) | — | |
| SCHEMBL1848657 | 0.68 | — | — | |
| SCHEMBL13139338 | 0.68 | MEN1 (0.47) | — | |
| SCHEMBL28814042 | 0.68 | KMT2A (0.43) | — |
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-8148380-B2 | Antibacterial amide and sulfonamide substituted heterocyclic urea compounds | CRESTONE, INC. (US) | 2012-04-03 | — | — | US | disclosed |
| US-20120015941-A1 | Antibacterial Amide and Sulfonamide Substituted Heterocyclic Urea Compounds | CRESTONE, INC. (US) | 2012-01-19 | — | — | US | disclosed |