⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL85457 | 0.87 | — | — | |
| SCHEMBL6731352 | 0.75 | — | — | |
| SCHEMBL9505413 | 0.75 | — | — | |
| SCHEMBL28774207 | 0.75 | — | — | |
| SCHEMBL7795632 | 0.75 | — | — | |
| Hydrogen Sulfide SCHEMBL9164199 | 0.75 | — | — | |
| SCHEMBL8971061 | 0.75 | — | — | |
| Phosphine SCHEMBL13723818 | 0.75 | — | — | |
| SCHEMBL3926170 | 0.75 | — | — | |
| SCHEMBL28860049 | 0.75 | — | — |
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-116891385-A | High-content YB 4 Preparation method of doped C/C composite material | 中南大学 | 2023-10-17 | — | — | CN | claimed |
| CN-116891385-A | High-content YB 4 Preparation method of doped C/C composite material | 中南大学 | 2023-10-17 | — | — | CN | disclosed |