⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL883553 | 0.71 | — | — | |
| SCHEMBL12028140 | 0.69 | — | — | |
| SCHEMBL13659138 | 0.69 | — | — | |
| SCHEMBL16472531 | 0.69 | — | — | |
| SCHEMBL2971552 | 0.69 | — | — | |
| SCHEMBL10052431 | 0.69 | — | — | |
| SCHEMBL8347954 | 0.69 | TRPA1 (0.50) | — | |
| SCHEMBL12647274 | 0.69 | — | — | |
| SCHEMBL21409642 | 0.69 | — | — | |
| SCHEMBL27597947 | 0.67 | HRH3 (0.55) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20170071207-A1 | INSECTICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2017-03-16 | — | — | US | disclosed |
| US-9545106-B2 | Insecticidal compounds | SYNGENTA PARTICIPATIONS AG (CH) | 2017-01-17 | — | — | US | disclosed |
| US-20140343049-A1 | DIHYDROFURAN DERIVATIVES AS INSECTICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2014-11-20 | — | — | US | disclosed |
| US-20140107056-A1 | INSECTICIDAL COMPOUNDS | SYNGENTA PARTICIPATIONS AG (CH) | 2014-04-17 | — | — | US | disclosed |