⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6526227 | 0.79 | — | — | |
| SCHEMBL4551435 | 0.73 | — | — | |
| SCHEMBL2951621 | 0.73 | — | — | |
| SCHEMBL4551024 | 0.71 | — | — | |
| SCHEMBL4550658 | 0.69 | CYP1A2 (0.31) | — | |
| SCHEMBL4395989 | 0.67 | — | — | |
| SCHEMBL4954955 | 0.67 | — | — | |
| SCHEMBL2695 | 0.65 | — | — | |
| SCHEMBL6780198 | 0.65 | — | — | |
| SCHEMBL12551238 | 0.63 | RAB9A (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0929519-B1 | BETA-SULFONYL HYDROXAMIC ACIDS AS MATRIX METALLOPROTEINASES INHIBITORS | UPJOHN CO (US) | 2005-02-23 | — | — | EP | claimed |