⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6564561 | 0.83 | TDP1 (0.39) | — | |
| SCHEMBL6152756 | 0.81 | — | — | |
| SCHEMBL11327941 | 0.81 | — | — | |
| SCHEMBL8722348 | 0.79 | ALDH1A1 (0.37) | — | |
| SCHEMBL28666055 | 0.79 | — | — | |
| SCHEMBL9620697 | 0.78 | LCK (0.40) | — | |
| SCHEMBL7537810 | 0.76 | CHRM1 (0.33) | — | |
| Methoxymethane SCHEMBL7865469 | 0.76 | ZDHHC7 (0.36) | — | |
| SCHEMBL1834073 | 0.75 | HDAC1 (0.46) | — | |
| SCHEMBL29602658 | 0.75 | HDAC1 (0.46) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0981958-B1 | INSECTICIDAL/ACARICIDAL AGENTS | SAGAMI CHEM RES (JP) | 2004-03-31 | — | — | EP | disclosed |
| US-6548511-B1 | Anilinopyrimidinone derivatives of given formula such as 2-(2,5-bis(trifluoromethyl)phenyl)amino-5-chloro-3-isobutyl-6 -trifluoromethyl-4(3H)-pyrimidinone; controlling pests of agricultural and horticultural products | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 2003-04-15 | — | — | US | disclosed |
| EP-0981958-A1 | INSECTICIDAL/ACARICIDAL AGENTS | SAGAMI CHEMICAL RESEARCH CENTER (JP) | 2000-03-01 | — | — | EP | disclosed |