⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2597216 | 0.93 | — | — | |
| SCHEMBL2597301 | 0.92 | — | — | |
| SCHEMBL2597442 | 0.91 | KDM4E (0.31) | — | |
| SCHEMBL2597283 | 0.90 | IDH1 (0.31) | — | |
| SCHEMBL2597261 | 0.90 | — | — | |
| SCHEMBL2597331 | 0.89 | USP1 (0.30) | — | |
| SCHEMBL2597329 | 0.88 | CA12 (0.32) | — | |
| SCHEMBL2597232 | 0.87 | USP1 (0.31) | — | |
| SCHEMBL2597425 | 0.87 | USP1 (0.30) | — | |
| SCHEMBL2597210 | 0.86 | USP1 (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2571865-A1 | 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES | Novartis AG (CH) | 2013-03-27 | — | — | EP | disclosed |
| US-20130053381-A1 | 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES | NOVARTIS AG | 2013-02-28 | — | — | US | disclosed |
| WO-2011144666-A1 | 2,4-DIOXO-1,4-DIHYDRO-2H-QUINAZOLIN-3-YL-SULFONAMIDE DERIVATIVES | NOVARTIS AG (CH) | 2011-11-24 | — | — | WO | disclosed |