⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28251855 | 1.00 | — | — | |
| SCHEMBL28585568 | 0.93 | — | — | |
| Lithium Ion SCHEMBL29617453 | 0.93 | — | — | |
| SCHEMBL1924367 | 0.91 | — | — | |
| SCHEMBL20943732 | 0.91 | — | — | |
| SCHEMBL2868969 | 0.91 | — | — | |
| Lithium Ion SCHEMBL29516941 | 0.87 | — | — | |
| SCHEMBL30951772 | 0.83 | — | — | |
| SCHEMBL38652240 | 0.83 | — | — | |
| SCHEMBL30951771 | 0.83 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109261222-A | A kind of preparation method of the high stability bimetallic hollow core core/shell-type catalyst for the reaction of toluene steam reforming | 贵州理工学院 | 2019-01-25 | — | — | CN | disclosed |
| CN-109261222-A | A kind of preparation method of the high stability bimetallic hollow core core/shell-type catalyst for the reaction of toluene steam reforming | 贵州理工学院 | 2019-01-25 | — | — | CN | disclosed |