⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18073764 | 0.76 | — | — | |
| SCHEMBL775632 | 0.76 | TSHR (0.43) | — | |
| SCHEMBL20417820 | 0.72 | — | — | |
| SCHEMBL23140218 | 0.70 | — | — | |
| SCHEMBL598505 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL16135225 | 0.68 | CTSL (0.32) | — | |
| SCHEMBL15848918 | 0.68 | TSHR (0.35) | — | |
| SCHEMBL19865538 | 0.67 | TSHR (0.30) | — | |
| SCHEMBL21912620 | 0.67 | MEN1 (0.38) | — | |
| SCHEMBL13078663 | 0.65 | LMNA (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2021053198-A1 | POLYMER OR POLYCONDENSATE BASED ON PEPTIDE, LINKER AND OPTIONALLY OTHER MONOMERS AND METHOD FOR PREPARING THE SAME | ECOLE POLYTECHNIQUE FEDERALE DE LAUSANNE (EPFL) (CH) | 2021-03-25 | — | — | WO | disclosed |