⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14722233 | 0.81 | — | — | |
| SCHEMBL901820 | 0.73 | CHRNA1 (0.36) | — | |
| SCHEMBL14721916 | 0.70 | — | — | |
| SCHEMBL1935674 | 0.69 | — | — | |
| SCHEMBL14721704 | 0.69 | — | — | |
| SCHEMBL2355523 | 0.68 | — | — | |
| Hydrochloric Acid SCHEMBL15155575 | 0.68 | — | — | |
| SCHEMBL14722616 | 0.68 | — | — | |
| SCHEMBL14722311 | 0.67 | AR (0.32) | — | |
| SCHEMBL27965960 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2013026726-A1 | DIHYDROFURAN DERIVATIVES AS INSECTICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2013-02-28 | — | — | WO | disclosed |