⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10868870 | 0.65 | PLK4 (0.32) | — | |
| SCHEMBL219949 | 0.59 | PKM (0.33) | — | |
| SCHEMBL20113010 | 0.57 | — | — | |
| SCHEMBL3004979 | 0.57 | — | — | |
| SCHEMBL30323275 | 0.55 | — | — | |
| SCHEMBL3826627 | 0.53 | — | — | |
| SCHEMBL2049728 | 0.53 | — | — | |
| SCHEMBL1050861 | 0.51 | — | — | |
| SCHEMBL277736 | 0.51 | — | — | |
| SCHEMBL29479476 | 0.51 | — | — |
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-7407988-B2 | Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors | TOPOTARGET UK LIMITED (GB) | 2008-08-05 | — | — | US | disclosed |
| US-20070004806-A1 | Carbamic acid compounds comprising a sulfonamide linkage as HDAC inhibitors | TOPOTARGET UK LIMITED (GB) | 2007-01-04 | — | — | US | disclosed |