⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1934488 | 0.84 | — | — | |
| Trifluoroacetic Acid SCHEMBL28322035 | 0.76 | — | — | |
| Trifluoroacetic Acid SCHEMBL30279918 | 0.72 | — | — | |
| SCHEMBL29474961 | 0.67 | LMNA (0.33) | — | |
| SCHEMBL27638 | 0.64 | — | — | |
| SCHEMBL6051195 | 0.64 | — | — | |
| SCHEMBL18281329 | 0.63 | — | — | |
| SCHEMBL933257 | 0.62 | — | — | |
| SCHEMBL29427258 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL21408262 | 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 |
|---|---|---|---|---|---|---|---|
| CN-102762208-A | Pyrazolopyrimidines and related heterocycles as ck2 inhibitors | CYLENE PHARMACEUTICALS INC | 2012-10-31 | — | — | CN | disclosed |