⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11582709 | 1.00 | — | — | |
| Fluoride SCHEMBL29259634 | 0.89 | — | — | |
| Water SCHEMBL28491583 | 0.89 | — | — | |
| SCHEMBL27882029 | 0.89 | — | — | |
| SCHEMBL7948908 | 0.87 | — | — | |
| SCHEMBL1178591 | 0.87 | — | — | |
| SCHEMBL1875275 | 0.87 | — | — | |
| SCHEMBL178192 | 0.87 | — | — | |
| SCHEMBL166257 | 0.87 | — | — | |
| SCHEMBL8353125 | 0.87 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110760709-A | Preparation method of graphene reinforced magnesium composite material | 河北工业大学 | 2020-02-07 | — | — | CN | claimed |
| CN-110760709-B | Preparation method of graphene reinforced magnesium composite material | 河北工业大学 | 2021-07-27 | — | — | CN | disclosed |
| CN-110760709-A | Preparation method of graphene reinforced magnesium composite material | 河北工业大学 | 2020-02-07 | — | — | CN | disclosed |