⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28636366 | 0.88 | TYMS (0.30) | — | |
| SCHEMBL29414478 | 0.88 | TYMS (0.30) | — | |
| SCHEMBL8165596 | 0.85 | TYMS (0.31) | — | |
| SCHEMBL13403288 | 0.85 | TYMS (0.30) | — | |
| SCHEMBL8166011 | 0.84 | TYMS (0.32) | — | |
| SCHEMBL18133272 | 0.81 | TYMP (0.33) | — | |
| SCHEMBL13255805 | 0.79 | — | — | |
| SCHEMBL21901657 | 0.78 | LMNA (0.36) | — | |
| SCHEMBL30358015 | 0.78 | HSP90AA1 (0.40) | — | |
| SCHEMBL27206891 | 0.78 | HSP90AA1 (0.40) | — |
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-2705159-B1 | METHODS FOR SEQUENCING, AMPLIFICATION AND DETECTION OF NUCLEIC ACIDS COMPRISING INTERNALLY LABELLED PRIMER | QIAGEN GMBH (DE) | 2018-03-21 | — | — | EP | disclosed |