⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10983875 | 1.00 | — | — | |
| SCHEMBL10973992 | 0.82 | GRIK1 (0.30) | — | |
| SCHEMBL10973987 | 0.82 | GRIK1 (0.30) | — | |
| SCHEMBL10980775 | 0.79 | GRIK1 (0.43) | — | |
| SCHEMBL10980772 | 0.79 | GRIK1 (0.43) | — | |
| SCHEMBL9785500 | 0.76 | GRIK1 (0.31) | — | |
| SCHEMBL8587066 | 0.76 | GRIK1 (0.31) | — | |
| SCHEMBL7171845 | 0.74 | ALDH1A1 (0.35) | — | |
| SCHEMBL5420620 | 0.74 | GRIK1 (0.39) | — | |
| SCHEMBL9785440 | 0.74 | GRIK1 (0.39) | — |
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-4492799-A | INSECTICIDES, MITICIDES | UNION CARBIDE CORPORATION (US) | 1985-01-08 | — | — | US | disclosed |