⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2135540 | 0.65 | — | — | |
| SCHEMBL2774955 | 0.41 | — | — | |
| SCHEMBL2362493 | 0.41 | KDM4E (0.41) | — | |
| SCHEMBL8465809 | 0.41 | CASP1 (0.50) | — | |
| SCHEMBL1246293 | 0.39 | MEN1 (0.30) | — | |
| SCHEMBL157954 | 0.33 | — | — | |
| SCHEMBL23451840 | 0.29 | — | — | |
| Charcoal, Activated SCHEMBL9002850 | 0.29 | — | — | |
| SCHEMBL8227000 | 0.29 | — | — | |
| SCHEMBL23451932 | 0.29 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2838533-B1 | COMPOSITIONS AND METHODS OF MODULATING 15-PGDH ACTIVITY | UNIV CASE WESTERN RESERVE (US) | 2017-10-04 | — | — | EP | disclosed |
| WO-2015151001-A1 | SULFONAMIDE COMPOUNDS AS VOLTAGE GATED SODIUM CHANNEL MODULATORS | LUPIN LIMITED (IN) | 2015-10-08 | — | — | WO | disclosed |