⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19667919 | 0.75 | — | — | |
| SCHEMBL24384253 | 0.75 | TSHR (0.39) | — | |
| SCHEMBL24799640 | 0.68 | — | — | |
| SCHEMBL28382905 | 0.66 | — | — | |
| SCHEMBL9413479 | 0.64 | — | — | |
| SCHEMBL21286498 | 0.64 | — | — | |
| SCHEMBL24816608 | 0.64 | — | — | |
| SCHEMBL6353382 | 0.62 | — | — | |
| SCHEMBL627923 | 0.62 | — | — | |
| SCHEMBL20994190 | 0.60 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101597246-B | Preparation method of 2-(3, 3, 3-trifluoro propyl) benzsulfamide (I) and midbody thereof | JIANGSU AGROCHEM LAB CO LTD | 2013-07-17 | — | — | CN | claimed |