⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24954 | 1.00 | — | — | |
| SCHEMBL31443191 | 1.00 | — | — | |
| SCHEMBL2429370 | 1.00 | — | — | |
| SCHEMBL1897494 | 1.00 | — | — | |
| SCHEMBL2457940 | 1.00 | — | — | |
| SCHEMBL6837553 | 1.00 | — | — | |
| SCHEMBL10776338 | 1.00 | — | — | |
| SCHEMBL23646974 | 0.82 | — | — | |
| SCHEMBL1982858 | 0.82 | — | — | |
| SCHEMBL3992688 | 0.82 | — | — |
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-112430089-B | ReO (ReO) 3 Shear structure MoNb 6 O 18 Method for producing materials and use thereof | 桂林理工大学 | 2022-09-30 | — | — | CN | disclosed |
| CN-112430089-B | ReO (ReO) 3 Shear structure MoNb 6 O 18 Method for producing materials and use thereof | 桂林理工大学 | 2022-09-30 | — | — | CN | disclosed |