⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19608553 | 0.78 | PKM (0.41) | — | |
| SCHEMBL762702 | 0.72 | — | — | |
| SCHEMBL8011310 | 0.70 | — | — | |
| SCHEMBL19705401 | 0.70 | — | — | |
| SCHEMBL9574543 | 0.70 | — | — | |
| SCHEMBL8801537 | 0.70 | — | — | |
| SCHEMBL12342914 | 0.67 | TDP1 (0.41) | — | |
| SCHEMBL3524639 | 0.67 | TDP1 (0.44) | — | |
| SCHEMBL8621897 | 0.67 | — | — | |
| SCHEMBL3520507 | 0.67 | — | — |
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-0534266-A1 | Sulfonylaminocarbonyltriazolones with two through oxygen bonded substituents | BAYER AG (DE) | 1993-03-31 | — | — | EP | claimed |