⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29280996 | 0.71 | — | — | |
| SCHEMBL1387866 | 0.69 | — | — | |
| SCHEMBL18520772 | 0.63 | — | — | |
| SCHEMBL3631213 | 0.63 | — | — | |
| SCHEMBL1387740 | 0.62 | ALDH1A1 (0.41) | — | |
| SCHEMBL18808104 | 0.60 | — | — | |
| SCHEMBL23448475 | 0.59 | — | — | |
| Dimethyl Sulfone SCHEMBL10950864 | 0.58 | — | — | |
| SCHEMBL4237667 | 0.56 | — | — | |
| SCHEMBL622472 | 0.56 | — | — |
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-3429355-B1 | SUBSTITUTED SULFONYLAMIDE FOR COMBATING ANIMAL PESTS | BAYER CROPSCIENCE AG (DE) | 2020-02-05 | — | — | EP | disclosed |