⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17017291 | 0.79 | — | — | |
| SCHEMBL18327197 | 0.79 | — | — | |
| SCHEMBL17017292 | 0.79 | — | — | |
| SCHEMBL890992 | 0.79 | — | — | |
| SCHEMBL1059901 | 0.76 | — | — | |
| SCHEMBL891118 | 0.73 | — | — | |
| SCHEMBL28393176 | 0.67 | — | — | |
| SCHEMBL1445577 | 0.67 | — | — | |
| SCHEMBL1598090 | 0.67 | — | — | |
| SCHEMBL149026 | 0.67 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110724077-A | Preparation method of 1,2, 3-trithio-ethyl-thiopropane | 山东益丰生化环保股份有限公司 | 2020-01-24 | — | — | CN | claimed |
| CN-110724077-A | Preparation method of 1,2, 3-trithio-ethyl-thiopropane | 山东益丰生化环保股份有限公司 | 2020-01-24 | — | — | CN | disclosed |
| CN-110724077-A | Preparation method of 1,2, 3-trithio-ethyl-thiopropane | 山东益丰生化环保股份有限公司 | 2020-01-24 | — | — | CN | disclosed |
| CN-110724077-A | Preparation method of 1,2, 3-trithio-ethyl-thiopropane | 山东益丰生化环保股份有限公司 | 2020-01-24 | — | — | CN | disclosed |