⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL466524 | 0.84 | — | — | |
| SCHEMBL7035216 | 0.82 | — | — | |
| SCHEMBL466858 | 0.71 | HTR1A (0.34) | — | |
| SCHEMBL8069246 | 0.68 | — | — | |
| SCHEMBL668664 | 0.67 | — | — | |
| SCHEMBL21647351 | 0.66 | — | — | |
| SCHEMBL7035939 | 0.66 | — | — | |
| Methane SCHEMBL466523 | 0.65 | — | — | |
| SCHEMBL7031775 | 0.64 | ALDH1A1 (0.33) | — | |
| SCHEMBL7036707 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2505613-A1 | COMPOSITION, CURED PRODUCT, AND ELECTRONIC DEVICE | JSR Corporation (JP) | 2012-10-03 | — | — | EP | disclosed |
| US-20030065117-A1 | Modified silicone compound, process of producing the same, and cured object obtained therefrom | NATIONAL INSTITUTE OF ADVANCED INDUSTRIAL SCIENCE AND TECHNOLOGY (JP) | 2003-04-03 | — | — | US | disclosed |