⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17885816 | 0.76 | — | — | |
| SCHEMBL24642324 | 0.65 | — | — | |
| SCHEMBL8471585 | 0.64 | — | — | |
| SCHEMBL21018811 | 0.62 | — | — | |
| SCHEMBL1050915 | 0.59 | — | — | |
| SCHEMBL17472738 | 0.56 | — | — | |
| SCHEMBL1051198 | 0.56 | — | — | |
| SCHEMBL6161854 | 0.56 | RAB9A (0.34) | — | |
| SCHEMBL1053121 | 0.56 | RAB9A (0.34) | — | |
| SCHEMBL125003 | 0.56 | — | — |
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-2022170971-A1 | BIOACTIVE SUBSTANCE CONJUGATE, PREPARATION METHOD THEREFOR AND USE THEREOF | 苏州宜联生物医药有限公司 | 2022-08-18 | — | — | WO | disclosed |