⚠ 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 | |
|---|---|---|---|---|
| Thioacetamide SCHEMBL22851 | 1.00 | — | — | |
| Thioacetamide SCHEMBL5998997 | 1.00 | TSHR (0.56) | — | |
| Thioacetamide SCHEMBL8347261 | 0.94 | — | — | |
| Thioacetamide SCHEMBL10589439 | 0.94 | — | — | |
| Thioacetamide SCHEMBL29173346 | 0.94 | — | — | |
| Thioacetamide SCHEMBL10882094 | 0.94 | — | — | |
| Thioacetamide SCHEMBL10589443 | 0.94 | — | — | |
| Thioacetamide SCHEMBL29575957 | 0.94 | — | — | |
| Thioacetamide SCHEMBL11777807 | 0.94 | — | — | |
| Thioacetamide SCHEMBL29092377 | 0.94 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109148857-A | A kind of preparation method of four vanadic sulfides of anode material of lithium-ion battery/carbon nanotube | 中南大学 | 2019-01-04 | — | — | CN | disclosed |
| CN-100506386-C | Method for preparing fuel cell catalyst using sulfide precipitation process | TSINGHUA UNIV JIANGSU FENGCHI (CN) | 2009-07-01 | — | — | CN | disclosed |
| CN-101287481-A | A pharmaceutical composition useful for the treatment of hepatocellular carcinoma | COUNCIL SCIENT IND RES (IN) | 2008-10-15 | — | — | CN | disclosed |
| CN-1814349-A | Method for preparing fuel cell catalyst using sulfide precipitation process | UNIV TSINGHUA (CN) | 2006-08-09 | — | — | CN | disclosed |
| US-20060078921-A1 | Biomarkers and expression profiles for toxicology | BOESS FRANZISKA | 2006-04-13 | — | — | US | disclosed |