⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3342061 | 0.78 | — | — | |
| SCHEMBL1553028 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL23296440 | 0.69 | CYP2D6 (0.35) | — | |
| SCHEMBL193495 | 0.66 | — | — | |
| SCHEMBL3070710 | 0.66 | — | — | |
| Iodide SCHEMBL6470627 | 0.64 | CYP2D6 (0.35) | — | |
| Iodide SCHEMBL7849934 | 0.64 | CYP2D6 (0.35) | — | |
| SCHEMBL6397713 | 0.61 | — | — | |
| SCHEMBL24098344 | 0.59 | CYP2D6 (0.32) | — | |
| SCHEMBL10827807 | 0.59 | — | — |
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-2069310-A2 | SULFONYLPYRAZOLINE CARBOXAMIDINE DERIVATIVES AS 5-HT6 ANTAGONISTS | Solvay Pharmaceuticals B.V. (NL) | 2009-06-17 | — | — | EP | disclosed |
| WO-2008034863-A2 | SULFONYLPYRAZOLINE CARBOXAMIDINE DERIVATIVES AS 5-HT6 ANTAGONISTS | SOLVAY PHARMACEUTICALS B.V. (NL) | 2008-03-27 | — | — | WO | disclosed |