⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12957924 | 0.79 | — | — | |
| SCHEMBL24259934 | 0.77 | — | — | |
| SCHEMBL20960299 | 0.76 | — | — | |
| SCHEMBL16558980 | 0.76 | — | — | |
| SCHEMBL14190340 | 0.75 | — | — | |
| SCHEMBL23128301 | 0.75 | HDAC4 (0.30) | — | |
| SCHEMBL24624860 | 0.74 | — | — | |
| SCHEMBL13233684 | 0.74 | — | — | |
| SCHEMBL13227961 | 0.74 | — | — | |
| SCHEMBL19263982 | 0.74 | GRN (0.33) | — |
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-3398958-B1 | POLYAMINOACID, PROTEIN-POLYAMINOACID CONJUGATE AND PREPARATION METHOD THEREFOR | UNIV BEIJING (CN) | 2022-02-23 | — | — | EP | disclosed |