⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10769127 | 0.82 | LMNA (0.31) | — | |
| SCHEMBL3082021 | 0.71 | — | — | |
| SCHEMBL6628074 | 0.69 | LMNA (0.47) | — | |
| SCHEMBL21045867 | 0.69 | LMNA (0.47) | — | |
| SCHEMBL19088370 | 0.69 | — | — | |
| SCHEMBL3282197 | 0.65 | — | — | |
| SCHEMBL16592176 | 0.64 | — | — | |
| SCHEMBL5293615 | 0.63 | — | — | |
| SCHEMBL13496631 | 0.63 | THRB (0.50) | — | |
| SCHEMBL12721896 | 0.62 | — | — |
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-20140330032-A1 | MICROBIAL PRODUCTION OF CHEMICAL PRODUCTS AND RELATED COMPOSITIONS, METHODS AND SYSTEMS | OPX BIOTECHNOLOGIES, INC. | 2014-11-06 | — | — | US | disclosed |