⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28029186 | 0.94 | — | — | |
| SCHEMBL28034140 | 0.94 | — | — | |
| SCHEMBL604419 | 0.93 | — | — | |
| Phosphine SCHEMBL27795177 | 0.86 | — | — | |
| SCHEMBL3347453 | 0.86 | — | — | |
| SCHEMBL10761808 | 0.86 | — | — | |
| SCHEMBL27585199 | 0.80 | — | — | |
| SCHEMBL5984899 | 0.80 | — | — | |
| SCHEMBL27585197 | 0.76 | — | — | |
| Methyl Alcohol SCHEMBL27320791 | 0.76 | — | — |
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-109616334-B | Preparation method of carbon-coated metal oxide nanodot-loaded graphene composite material | 中国科学院兰州化学物理研究所 | 2020-02-28 | — | — | CN | disclosed |
| CN-109616334-A | The preparation method of carbon-clad metal oxidate nano point load graphene composite material | 中国科学院兰州化学物理研究所 | 2019-04-12 | — | — | CN | disclosed |