⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31476241 | 1.00 | — | — | |
| SCHEMBL31476269 | 0.87 | CYP1A2 (0.35) | — | |
| SCHEMBL31476295 | 0.87 | CYP1A2 (0.35) | — | |
| SCHEMBL20276043 | 0.87 | — | — | |
| SCHEMBL17529564 | 0.87 | CYP1A2 (0.35) | — | |
| SCHEMBL31476226 | 0.87 | — | — | |
| SCHEMBL31476232 | 0.87 | — | — | |
| SCHEMBL17529569 | 0.87 | SIGMAR1 (0.31) | — | |
| SCHEMBL24285908 | 0.85 | — | — | |
| SCHEMBL24314116 | 0.84 | S1PR1 (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 |
|---|---|---|---|---|---|---|---|
| US-20250081967-A1 | PESTICIDALLY ACTIVE HETEROCYCLIC DERIVATIVES WITH SULFOXIMINE CONTAINING SUBSTITUENTS | SYNGENTA CROP PROTECTION AG (CH) | 2025-03-13 | — | — | US | disclosed |