⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10103742 | 0.81 | TP53 (0.32) | — | |
| SCHEMBL14037711 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL28303940 | 0.74 | — | — | |
| SCHEMBL12049599 | 0.72 | — | — | |
| SCHEMBL13293732 | 0.70 | — | — | |
| SCHEMBL21241747 | 0.70 | KDM4E (0.33) | — | |
| SCHEMBL11969497 | 0.70 | — | — | |
| SCHEMBL9142617 | 0.70 | CXCL8 (0.41) | — | |
| SCHEMBL11892890 | 0.67 | — | — | |
| SCHEMBL10174695 | 0.65 | TSHR (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2030971-B1 | PEST CONTROL AGENT CONTAINING NOVEL PYRIDYL-METHANAMINE DERIVATIVE OR SALT THEREOF | ISHIHARA SANGYO KAISHA (JP) | 2011-10-12 | — | — | EP | disclosed |
| EP-2030971-A1 | PEST CONTROL AGENT CONTAINING NOVEL PYRIDYL-METHANAMINE DERIVATIVE OR SALT THEREOF | ISHIHARA SANGYO KAISHA, LTD. (JP) | 2009-03-04 | — | — | EP | disclosed |