⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2557762 | 0.81 | — | — | |
| SCHEMBL83050 | 0.81 | — | — | |
| SCHEMBL4460285 | 0.77 | — | — | |
| SCHEMBL3119197 | 0.77 | — | — | |
| SCHEMBL2909205 | 0.69 | — | — | |
| SCHEMBL5274569 | 0.68 | TSHR (0.33) | — | |
| SCHEMBL11580125 | 0.67 | — | — | |
| SCHEMBL12077132 | 0.65 | — | — | |
| SCHEMBL4736595 | 0.64 | — | — | |
| SCHEMBL1819413 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114981349-A | Process for preparing modified fillers, compositions and articles containing said modified fillers | PPG工业俄亥俄公司 | 2022-08-30 | — | — | CN | disclosed |
| CN-114599717-A | Silica-graphene carbon composite particles and elastomeric materials comprising such particles | PPG工业俄亥俄公司 | 2022-06-07 | — | — | CN | disclosed |
| CN-108290445-B | Peroxide cured tread | 米其林集团总公司 | 2021-06-29 | — | — | CN | disclosed |
| CN-105916914-A | Disintegrable porous organo-metal oxide materials | 斯特拉斯堡大学 | 2016-08-31 | — | — | CN | disclosed |