⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1078901 | 0.84 | — | — | |
| SCHEMBL8225159 | 0.77 | PGK1 (0.32) | — | |
| SCHEMBL28022191 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL7106585 | 0.75 | — | — | |
| SCHEMBL2221057 | 0.75 | — | — | |
| SCHEMBL8497621 | 0.71 | — | — | |
| SCHEMBL11074881 | 0.69 | — | — | |
| SCHEMBL698748 | 0.69 | — | — | |
| SCHEMBL1285864 | 0.67 | — | — | |
| SCHEMBL1663629 | 0.67 | — | — |
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-111883748-A | Method for coating oxide film on surface of lithium ion battery anode powder material | 华南理工大学 | 2020-11-03 | — | — | CN | claimed |
| CN-111883748-A | Method for coating oxide film on surface of lithium ion battery anode powder material | 华南理工大学 | 2020-11-03 | — | — | CN | disclosed |