⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23666394 | 0.92 | — | — | |
| SCHEMBL23666365 | 0.92 | — | — | |
| SCHEMBL9480208 | 0.74 | — | — | |
| SCHEMBL20828535 | 0.73 | — | — | |
| SCHEMBL19771799 | 0.72 | — | — | |
| SCHEMBL23659110 | 0.71 | — | — | |
| SCHEMBL19063232 | 0.70 | — | — | |
| SCHEMBL22681185 | 0.68 | — | — | |
| SCHEMBL22521378 | 0.67 | — | — | |
| SCHEMBL18714897 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210221828-A1 | APPLICATION OF LITHIUM 4-METHOXYANILINE IN CATALYSIS OF HYDROBORATION REACTION OF IMINE AND BORANE | SOOCHOW UNIVERSITY (CN) | 2021-07-22 | — | — | US | disclosed |