⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6235339 | 0.80 | — | — | |
| SCHEMBL6234404 | 0.79 | ALDH1A1 (0.35) | — | |
| SCHEMBL27820805 | 0.68 | — | — | |
| SCHEMBL8732169 | 0.67 | ALDH1A1 (0.32) | — | |
| SCHEMBL6232749 | 0.67 | — | — | |
| SCHEMBL302654 | 0.65 | TSHR (0.36) | — | |
| Ammonia Solution, Strong SCHEMBL27810418 | 0.65 | ALDH1A1 (0.30) | — | |
| SCHEMBL6234721 | 0.65 | ALDH1A1 (0.32) | — | |
| SCHEMBL16520330 | 0.63 | — | — | |
| SCHEMBL28036493 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1549682-A1 | POLYMERS CONTAINING SILANE | Wacker Polymer Systems GmbH & Co. KG (DE) | 2005-07-06 | — | — | EP | disclosed |
| EP-1530595-A1 | POLYVINYL ALCOHOLS AND POLYVINYL ACETALS CONTAINING SILANE | Wacker Polymer Systems GmbH & Co. KG (DE) | 2005-05-18 | — | — | EP | disclosed |
| WO-2004013187-A1 | POLYMERS CONTAINING SILANE | WACKER POLYMER SYSTEMS GMBH & CO. KG (DE) | 2004-02-12 | — | — | WO | disclosed |
| WO-2004013190-A1 | POLYVINYL ALCOHOLS AND POLYVINYL ACETALS CONTAINING SILANE | WACKER POLYMER SYSTEMS GMBH & CO. KG (DE) | 2004-02-12 | — | — | WO | disclosed |