⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23633730 | 0.78 | ALDH1A1 (0.31) | — | |
| SCHEMBL23633740 | 0.76 | — | — | |
| SCHEMBL23633739 | 0.76 | — | — | |
| SCHEMBL2528815 | 0.73 | — | — | |
| SCHEMBL13118857 | 0.73 | — | — | |
| SCHEMBL1592320 | 0.73 | RET (0.32) | — | |
| SCHEMBL18513479 | 0.73 | — | — | |
| SCHEMBL4597731 | 0.72 | CYP19A1 (0.49) | — | |
| SCHEMBL17213197 | 0.72 | CYP19A1 (0.49) | — | |
| SCHEMBL23633725 | 0.72 | CYP19A1 (0.30) | — |
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-11059923-B2 | Preparation method for high-solid acrylic resin | WUXI ACRYL TECHNOLOGY CO., LTD (CN) | 2021-07-13 | — | — | US | disclosed |