⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20445412 | 0.77 | — | — | |
| SCHEMBL13851917 | 0.74 | — | — | |
| SCHEMBL25530501 | 0.72 | — | — | |
| SCHEMBL25530453 | 0.72 | — | — | |
| SCHEMBL25540986 | 0.72 | TSHR (0.31) | — | |
| SCHEMBL22014088 | 0.71 | — | — | |
| SCHEMBL4569252 | 0.71 | — | — | |
| SCHEMBL18427217 | 0.69 | PIK3CD (0.35) | — | |
| SCHEMBL4235510 | 0.65 | MAPK1 (0.36) | — | |
| SCHEMBL10038791 | 0.62 | TSHR (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20180214561-A1 | EIGHT-ARM POLYETHYLENE GLYCOL DERIVATIVE, PRODUCTION METHOD THEREFOR, AND MODIFIEDBIO-RELATEDSUBSTANCETHEREOF | XIAMEN SINOPEG BIOTECH CO., LTD. (CN) | 2018-08-02 | — | — | US | disclosed |