⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6401178 | 0.84 | — | — | |
| SCHEMBL6402243 | 0.81 | — | — | |
| SCHEMBL6402559 | 0.68 | — | — | |
| SCHEMBL17292787 | 0.66 | — | — | |
| SCHEMBL21142993 | 0.63 | — | — | |
| SCHEMBL6401175 | 0.61 | NPC1 (0.43) | — | |
| SCHEMBL28573301 | 0.56 | CYP3A4 (0.37) | — | |
| SCHEMBL17767270 | 0.51 | KDM1A (0.36) | — | |
| SCHEMBL12306470 | 0.48 | PDE2A (0.46) | — | |
| SCHEMBL20855110 | 0.47 | — | — |
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-20050107383-A1 | 3-ARYLPHENYL SULFIDE DERIVATIVE AND INSECTICIDE AND MITICIDE | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2005-05-19 | — | — | US | disclosed |
| US-6509354-B1 | Insecticides and miticides containing the 3-arylphenyl sulfide derivatives as an active ingredient. | KUMIAI CHEMICAL INDUSTRY CO., LTD. (JP) | 2003-01-21 | — | — | US | disclosed |