⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9851702 | 0.91 | — | — | |
| SCHEMBL9851750 | 0.89 | — | — | |
| SCHEMBL9851782 | 0.82 | PI4KA (0.31) | — | |
| SCHEMBL9851800 | 0.80 | PRMT5 (0.31) | — | |
| SCHEMBL2289573 | 0.71 | PI4KA (0.39) | — | |
| SCHEMBL9216490 | 0.70 | ADORA1 (0.34) | — | |
| SCHEMBL9223640 | 0.66 | — | — | |
| SCHEMBL4783246 | 0.65 | PI4KA (0.35) | — | |
| SCHEMBL1140780 | 0.64 | — | — | |
| SCHEMBL646508 | 0.61 | ADORA3 (0.42) | — |
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-0450102-A1 | NUCLEOSIDE DERIVATIVE | Yamasa Shoyu Kabushiki Kaisha (JP) | 1991-10-09 | — | — | EP | disclosed |