⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23011310 | 0.76 | — | — | |
| SCHEMBL14627528 | 0.72 | FDPS (0.40) | — | |
| SCHEMBL22021859 | 0.72 | CA1 (0.33) | — | |
| SCHEMBL627751 | 0.72 | — | — | |
| SCHEMBL8305433 | 0.71 | — | — | |
| SCHEMBL22179131 | 0.71 | OPRM1 (0.37) | — | |
| SCHEMBL598355 | 0.69 | TSHR (0.38) | — | |
| SCHEMBL19956515 | 0.69 | — | — | |
| SCHEMBL24786125 | 0.69 | — | — | |
| SCHEMBL23740572 | 0.67 | — | — |
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-3504340-B1 | TAGGED NUCLEOTIDES USEFUL FOR NANOPORE DETECTION | HOFFMANN LA ROCHE (CH) | 2021-08-11 | — | — | EP | disclosed |