⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL93341 | 0.89 | — | — | |
| SCHEMBL5474865 | 0.80 | — | — | |
| SCHEMBL29824025 | 0.80 | — | — | |
| SCHEMBL28648382 | 0.80 | — | — | |
| SCHEMBL29463968 | 0.80 | — | — | |
| SCHEMBL11113959 | 0.80 | — | — | |
| Water SCHEMBL4045923 | 0.80 | — | — | |
| SCHEMBL31512530 | 0.80 | — | — | |
| SCHEMBL2767352 | 0.80 | — | — | |
| SCHEMBL28470587 | 0.80 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111696790-A | Preparation method of high-dispersion graphene-ruthenium oxide nanocomposite | 江苏省特种设备安全监督检验研究院 | 2020-09-22 | — | — | CN | disclosed |