⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL72944 | 0.88 | — | — | |
| Propane SCHEMBL29231331 | 0.83 | — | — | |
| Cyclopropane SCHEMBL28598829 | 0.82 | — | — | |
| SCHEMBL575408 | 0.80 | TSHR (0.32) | — | |
| SCHEMBL557923 | 0.79 | CYP3A4 (0.30) | — | |
| SCHEMBL557569 | 0.78 | — | — | |
| SCHEMBL2384851 | 0.78 | TSHR (0.30) | — | |
| SCHEMBL556672 | 0.74 | CA1 (0.31) | — | |
| Cyclopropane SCHEMBL1955206 | 0.73 | — | — | |
| SCHEMBL1493029 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9074032-B2 | Membranes based on polyvinyl alcohol | WACKER CHEMIE AG (DE) | 2015-07-07 | — | — | US | disclosed |
| CN-102365304-B | Polyvinyl alcohol-based film | WACKER CHEMIE AG | 2014-06-18 | — | — | CN | disclosed |
| CN-102365304-A | Polyvinyl alcohol-based film | WACKER CHEMIE AG | 2012-02-29 | — | — | CN | disclosed |
| US-20120031843-A1 | Membranes based on polyvinyl alcohol | WACKER CHEMIE AG (DE) | 2012-02-09 | — | — | US | disclosed |