⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24091764 | 0.71 | SIGMAR1 (0.31) | — | |
| SCHEMBL1127576 | 0.71 | SIGMAR1 (0.31) | — | |
| SCHEMBL27371516 | 0.69 | — | — | |
| SCHEMBL27496124 | 0.69 | — | — | |
| SCHEMBL1901416 | 0.69 | — | — | |
| Iodide SCHEMBL7218735 | 0.67 | — | — | |
| Bromide SCHEMBL4652705 | 0.67 | — | — | |
| Iodide SCHEMBL7222763 | 0.67 | — | — | |
| SCHEMBL19052024 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL5144074 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-106103348-B | The purposes of sulphur compound and selenium compound as the precursor of nano structural material | 哥伦比亚大学（纽约）理事会 | 2018-07-31 | — | — | CN | disclosed |
| CN-106103348-A | Sulphur compound and selenium compound are as the purposes of the precursor of nano structural material | 哥伦比亚大学（纽约）理事会 | 2016-11-09 | — | — | CN | disclosed |