⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7758814 | 0.75 | — | — | |
| SCHEMBL58991 | 0.72 | — | — | |
| SCHEMBL4250358 | 0.72 | — | — | |
| SCHEMBL4247823 | 0.72 | — | — | |
| SCHEMBL23121453 | 0.71 | — | — | |
| SCHEMBL5694299 | 0.67 | — | — | |
| SCHEMBL231812 | 0.67 | — | — | |
| SCHEMBL4808929 | 0.67 | — | — | |
| SCHEMBL10527152 | 0.67 | — | — | |
| SCHEMBL1937424 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-108249774-A | A kind of method in the high-strength attachment hydrogel of glass surface | 北京赛特超润界面科技有限公司 | 2018-07-06 | — | — | CN | claimed |
| EP-1637535-B1 | Process for preparing mercaptoorganyl alkoxy silanes | DEGUSSA (DE) | 2007-02-28 | — | — | EP | disclosed |
| EP-1634884-A1 | Process for preparing mercaptoorganyl alkoxy silanes | Degussa GmbH (DE) | 2006-03-15 | — | — | EP | disclosed |