⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2964732 | 0.72 | — | — | |
| SCHEMBL5590460 | 0.65 | — | — | |
| SCHEMBL9689059 | 0.59 | — | — | |
| SCHEMBL11645832 | 0.53 | — | — | |
| SCHEMBL11965844 | 0.51 | — | — | |
| SCHEMBL11965842 | 0.48 | — | — | |
| SCHEMBL17733009 | 0.46 | — | — | |
| SCHEMBL2996373 | 0.43 | — | — | |
| SCHEMBL22407244 | 0.43 | — | — | |
| SCHEMBL14973298 | 0.41 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105829456-B | Pass through the surface of chain structure modified metal-oxide | 瓦克化学股份公司 | 2018-02-23 | — | — | CN | disclosed |
| EP-3083841-B1 | MODIFYING THE SURFACES OF METAL OXIDES BY MEANS OF CHAIN-LIKE STRUCTURES | WACKER CHEMIE AG (DE) | 2018-02-07 | — | — | EP | disclosed |
| US-9617428-B2 | Modifying the surfaces of metal oxides by means of chain-like structures | WACKER CHEMIE AG (DE) | 2017-04-11 | — | — | US | disclosed |
| US-20160312034-A1 | MODIFYING THE SURFACES OF METAL OXIDES BY MEANS OF CHAIN-LIKE STRUCTURES | WACKER CHEMIE AG (DE) | 2016-10-27 | — | — | US | disclosed |
| EP-3083841-A1 | MODIFYING THE SURFACES OF METAL OXIDES BY MEANS OF CHAIN-LIKE STRUCTURES | Wacker Chemie AG (DE) | 2016-10-26 | — | — | EP | disclosed |
| CN-105829456-A | Modifying the surfaces of metal oxides by means of chain-like structures | 瓦克化学股份公司 | 2016-08-03 | — | — | CN | disclosed |
| WO-2015091153-A1 | MODIFYING THE SURFACES OF METAL OXIDES BY MEANS OF CHAIN-LIKE STRUCTURES | WACKER CHEMIE AG (DE) | 2015-06-25 | — | — | WO | disclosed |