⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13656193 | 0.74 | MAPK1 (0.31) | — | |
| SCHEMBL26324978 | 0.71 | ALDH1A1 (0.32) | — | |
| SCHEMBL16382326 | 0.70 | MAPK1 (0.33) | — | |
| SCHEMBL21445160 | 0.69 | — | — | |
| SCHEMBL21829185 | 0.69 | — | — | |
| SCHEMBL23571707 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL24445281 | 0.67 | ALDH1A1 (0.30) | — | |
| SCHEMBL208340 | 0.67 | MAPK1 (0.31) | — | |
| SCHEMBL21204864 | 0.65 | TSHR (0.31) | — | |
| SCHEMBL21128645 | 0.64 | TDP1 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3359552-B1 | COPPER ELECTROPLATING BATHS CONTAINING COMPOUNDS OF REACTION PRODUCTS OF AMINES, POLYACRYLAMIDES AND SULTONES | ROHM & HAAS ELECT MAT (US) | 2020-04-01 | — | — | EP | disclosed |