⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28465504 | 0.80 | — | — | |
| SCHEMBL30549543 | 0.76 | — | — | |
| SCHEMBL28865045 | 0.76 | — | — | |
| SCHEMBL27030844 | 0.67 | — | — | |
| SCHEMBL1069823 | 0.67 | — | — | |
| SCHEMBL5888231 | 0.66 | — | — | |
| SCHEMBL27802766 | 0.65 | — | — | |
| SCHEMBL7869092 | 0.64 | TSHR (0.31) | — | |
| SCHEMBL29427258 | 0.63 | — | — | |
| SCHEMBL30393948 | 0.63 | TSHR (0.31) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024242120-A1 | PATTERN FORMING METHOD AND PROCESSING LIQUID FOR METAL COMPOUND-CONTAINING FILM | 東京応化工業株式会社 | 2024-11-28 | — | — | WO | disclosed |
| CN-100384840-C | 2-pyrimidine oxy-benzoic acid [2-(pyrimidine amino methyl)]benester compound, its preparation and use thereof | SHANGHAI INST ORGANIC CHEM (CN) | 2008-04-30 | — | — | CN | disclosed |
| CN-1746167-A | 2-pyrimidine oxy-benzoic acid [2-(pyrimidine amino methyl)] benester compound, preparation method and its usage | SHANGHAI INST ORGANIC CHEM (CN) | 2006-03-15 | — | — | CN | disclosed |