⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL911160 | 1.00 | — | — | |
| SCHEMBL292541 | 1.00 | — | — | |
| SCHEMBL10483629 | 0.82 | — | — | |
| SCHEMBL910682 | 0.82 | — | — | |
| SCHEMBL3778747 | 0.82 | — | — | |
| SCHEMBL3777372 | 0.82 | — | — | |
| SCHEMBL3470859 | 0.82 | — | — | |
| SCHEMBL3770435 | 0.82 | — | — | |
| SCHEMBL1146441 | 0.82 | — | — | |
| Water SCHEMBL7877601 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114849754-A | Methanol carbonylation catalysis system based on nano carbon nitride-acetic acid dispersion liquid, and preparation method and application thereof | 江苏索普化工股份有限公司 | 2022-08-05 | — | — | CN | disclosed |