⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15426524 | 1.00 | — | — | |
| SCHEMBL28142684 | 0.93 | SLC6A4 (0.34) | — | |
| SCHEMBL24308462 | 0.84 | — | — | |
| SCHEMBL5585336 | 0.79 | KDM4E (0.31) | — | |
| SCHEMBL6658044 | 0.78 | — | — | |
| SCHEMBL24718527 | 0.78 | — | — | |
| SCHEMBL25349071 | 0.78 | — | — | |
| SCHEMBL13448668 | 0.78 | — | — | |
| Iodide SCHEMBL28867004 | 0.76 | EHMT2 (0.32) | — | |
| SCHEMBL3801077 | 0.76 | SLC6A4 (0.31) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1836238-A1 | FUNCTIONALIZED POLYMERS AND IMPROVED TIRES THEREFROM | Bridgestone Corporation (JP) | 2007-09-26 | — | — | EP | claimed |
| WO-2006076629-A1 | FUNCTIONALIZED POLYMERS AND IMPROVED TIRES THEREFROM | BRIDGESTONE CORPORATION (JP) | 2006-07-20 | — | — | WO | claimed |
| US-20120323003-A1 | TETRAHYDROISOQUINOLINE SULFONAMIDE DERIVATIVES, THE PREPARATION THEREOF, AND THE USE OF THE SAME IN THERAPEUTICS | SANOFI (FR) | 2012-12-20 | — | — | US | disclosed |
| US-20110269700-A1 | GLUCOSIDE DERIVATIVES AND USES THEREOF | NOVARTIS AG | 2011-11-03 | — | — | US | disclosed |