⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18638038 | 0.72 | — | — | |
| SCHEMBL3791558 | 0.63 | — | — | |
| SCHEMBL3904952 | 0.63 | — | — | |
| SCHEMBL18869 | 0.61 | — | — | |
| SCHEMBL30018832 | 0.58 | — | — | |
| SCHEMBL31571168 | 0.58 | — | — | |
| SCHEMBL29360664 | 0.58 | — | — | |
| SCHEMBL2006919 | 0.58 | — | — | |
| SCHEMBL32680463 | 0.54 | — | — | |
| SCHEMBL22580336 | 0.54 | — | — |
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-3859009-A1 | METHOD FOR EVALUATING QUALITY OF DEPHOSPHORYLATION REAGENT AND METHOD FOR DETECTING TARGET NUCLEIC ACID | Toray Industries, Inc. (JP) | 2021-08-04 | — | — | EP | disclosed |