⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3763062 | 0.87 | ALDH1A1 (0.33) | — | |
| SCHEMBL130329 | 0.82 | TSHR (0.34) | — | |
| SCHEMBL3765164 | 0.82 | ALDH1A1 (0.31) | — | |
| SCHEMBL3763903 | 0.79 | ALDH1A1 (0.36) | — | |
| SCHEMBL4581412 | 0.78 | — | — | |
| Ethylene Glycol SCHEMBL11320482 | 0.77 | TSHR (0.33) | — | |
| SCHEMBL284457 | 0.75 | TSHR (0.32) | — | |
| SCHEMBL320955 | 0.72 | TSHR (0.33) | — | |
| SCHEMBL285034 | 0.72 | TSHR (0.57) | — | |
| SCHEMBL575321 | 0.72 | TSHR (0.33) | — |
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-8999323-B2 | Composition that can be cured by polymerisation for the production of biodegradable, biocompatible, cross-linkable polymers on the basis of polyvinyl alcohol | TECHNISCHE UNIVERSITÄT WIEN (AT) | 2015-04-07 | — | — | US | disclosed |
| US-20100303804-A1 | COMPOSITION THAT CAN BE CURED BY POLYMERISATION FOR THE PRODUCTION OF BIODEGRADABLE, BIOCOMPATIBLE, CROSS-LINKABLE POLYMERS ON THE BASIS OF POLYVINYL ALCOHOL | TECHNISCHE UNIVERSITAT WIEN (AT) | 2010-12-02 | — | — | US | disclosed |