⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19543049 | 0.87 | LMNA (0.33) | — | |
| SCHEMBL19543086 | 0.85 | — | — | |
| SCHEMBL28590301 | 0.77 | LMNA (0.30) | — | |
| SCHEMBL10593369 | 0.76 | TSHR (0.30) | — | |
| SCHEMBL19543432 | 0.75 | — | — | |
| SCHEMBL17299075 | 0.74 | LMNA (0.31) | — | |
| SCHEMBL13986670 | 0.74 | ALDH1A1 (0.32) | — | |
| SCHEMBL15148281 | 0.73 | — | — | |
| SCHEMBL20445503 | 0.71 | HTT (0.32) | — | |
| SCHEMBL17299072 | 0.70 | — | — |
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 2 patents. 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 |
| US-20170312363-A1 | MULTIFUNCTIONALIZED POLYETHYLENE GLYCOL DERIVATIVE AND PREPARATION METHOD THEREFOR | XIAMEN SINOPEG BIOTECH CO., LTD. (CN) | 2017-11-02 | — | — | US | disclosed |