⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2879832 | 0.79 | KMT2A (0.31) | — | |
| SCHEMBL5016056 | 0.79 | — | — | |
| SCHEMBL25379520 | 0.73 | — | — | |
| SCHEMBL454570 | 0.72 | SLC6A3 (0.34) | — | |
| Hydrogen Peroxide SCHEMBL28228864 | 0.71 | NOS2 (0.32) | — | |
| SCHEMBL2879688 | 0.71 | TP53 (0.30) | — | |
| SCHEMBL20168 | 0.70 | — | — | |
| SCHEMBL38222 | 0.70 | — | — | |
| SCHEMBL10875099 | 0.70 | — | — | |
| SCHEMBL28132514 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-108384246-A | A kind of preparation method of addition thermal conductive Silica hydrogel | 王景硕 | 2018-08-10 | — | — | CN | claimed |
| CN-108384246-A | A kind of preparation method of addition thermal conductive Silica hydrogel | 王景硕 | 2018-08-10 | — | — | CN | disclosed |
| EP-3116936-A1 | HIGH PERMITTIVITY POLYMERS BASED ON FUNCTIONALIZED SILICONES | EMPA Eidgenössische Materialprüfungs- und Forschungsanstalt (CH) | 2017-01-18 | — | — | EP | disclosed |
| WO-2015135086-A1 | HIGH PERMITTIVITY POLYMERS BASED ON FUNCTIONALIZED SILICONES | EMPA EIDGENÖSSISCHE MATERIALPRÜFUNGS- UND FORSCHUNGSANSTALT (CH) | 2015-09-17 | — | — | WO | disclosed |