⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24520072 | 0.77 | — | — | |
| SCHEMBL12050775 | 0.68 | — | — | |
| SCHEMBL22695195 | 0.67 | — | — | |
| SCHEMBL23340802 | 0.63 | — | — | |
| SCHEMBL21539393 | 0.63 | — | — | |
| SCHEMBL24786766 | 0.63 | — | — | |
| SCHEMBL23710713 | 0.62 | MEN1 (0.30) | — | |
| SCHEMBL17607308 | 0.62 | — | — | |
| SCHEMBL18477415 | 0.61 | ALDH1A1 (0.33) | — | |
| SCHEMBL19225933 | 0.61 | — | — |
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-20170354610-A1 | MICROCELLULAR MICROSTRUCTURE AND METHOD FOR MANUFACTURING SAME | JUVIC INC. (KR) | 2017-12-14 | — | — | US | disclosed |