⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25610726 | 0.94 | — | — | |
| SCHEMBL18727452 | 0.82 | — | — | |
| SCHEMBL11426733 | 0.79 | — | — | |
| Hydrochloric Acid SCHEMBL11435346 | 0.77 | — | — | |
| SCHEMBL22686499 | 0.76 | — | — | |
| SCHEMBL22314090 | 0.75 | — | — | |
| SCHEMBL1678341 | 0.75 | — | — | |
| Iodide SCHEMBL2210494 | 0.74 | — | — | |
| SCHEMBL25776594 | 0.72 | — | — | |
| Water SCHEMBL11723715 | 0.72 | TSHR (0.35) | — |
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-3315531-A1 | 8-ARM POLYETHYLENE GLYCOL DERIVATIVE, MANUFACTURING METHOD AND MODIFIED BIO-RELATED SUBSTANCE THEREBY | Xiamen Sinopeg Biotech Co., Ltd. (CN) | 2018-05-02 | — | — | EP | disclosed |