⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21021884 | 0.86 | ALDH1A1 (0.38) | — | |
| SCHEMBL20076755 | 0.86 | ALDH1A1 (0.38) | — | |
| SCHEMBL21079049 | 0.82 | LMNA (0.30) | — | |
| SCHEMBL20076640 | 0.79 | LMNA (0.31) | — | |
| SCHEMBL21079081 | 0.79 | KDM1A (0.35) | — | |
| SCHEMBL21019049 | 0.77 | SLC6A4 (0.44) | — | |
| SCHEMBL21079021 | 0.77 | NOTUM (0.36) | — | |
| SCHEMBL24281814 | 0.72 | HTR2A (0.41) | — | |
| SCHEMBL21079011 | 0.72 | KDM1A (0.36) | — | |
| SCHEMBL20051055 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10993440-B2 | Molecules having pesticidal utility, and intermediates, compositions, and processes related thereto | DOW AGROSCIENCES LLC (US) | 2021-05-04 | — | — | US | disclosed |
| US-20190166847-A1 | MOLECULES HAVING PESTICIDAL UTILITY, AND INTERMEDIATES, COMPOSITIONS, AND PROCESSES RELATED THERETO | DOW AGROSCIENCES LLC (US) | 2019-06-06 | — | — | US | disclosed |