⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14402079 | 0.66 | — | — | |
| SCHEMBL9789987 | 0.59 | — | — | |
| SCHEMBL7120992 | 0.57 | ALDH1A1 (0.33) | — | |
| SCHEMBL19242727 | 0.56 | — | — | |
| SCHEMBL6899484 | 0.55 | — | — | |
| SCHEMBL31289367 | 0.55 | — | — | |
| SCHEMBL27697181 | 0.55 | — | — | |
| SCHEMBL23866151 | 0.54 | — | — | |
| SCHEMBL24465128 | 0.52 | GLB1 (0.32) | — | |
| SCHEMBL701060 | 0.52 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011025565-A1 | MORPHOLINONE COMPOUNDS AS FACTOR IXA INHIBITORS | MOCHIDA PHARMACEUTICAL CO., LTD. (JP) | 2011-03-03 | — | — | WO | disclosed |