⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL91545 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL3566697 | 0.77 | SLC6A2 (0.34) | — | |
| Hydrochloric Acid SCHEMBL2916914 | 0.77 | — | — | |
| SCHEMBL12524842 | 0.76 | — | — | |
| SCHEMBL24558960 | 0.76 | — | — | |
| SCHEMBL30999153 | 0.71 | — | — | |
| SCHEMBL21385583 | 0.71 | — | — | |
| SCHEMBL24843813 | 0.71 | — | — | |
| SCHEMBL2920785 | 0.70 | SLC6A1 (0.32) | — | |
| SCHEMBL23654374 | 0.68 | IKBKB (0.30) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021213929-A1 | PESTICIDALLY ACTIVE SUBSTITUTED 1,3-DIHYDRO-2H-IMIDAZO[4,5-C]PYRIDIN-2-ONE DERIVATIVES WITH SULFUR CONTAINING SUBSTITUENTS | SYNGENTA CROP PROTECTION AG (CH) | 2021-10-28 | — | — | WO | disclosed |