⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17075902 | 0.77 | GRM4 (0.32) | — | |
| SCHEMBL5464728 | 0.76 | — | — | |
| SCHEMBL1429916 | 0.73 | — | — | |
| SCHEMBL4018045 | 0.73 | — | — | |
| SCHEMBL20212144 | 0.73 | — | — | |
| SCHEMBL108849 | 0.73 | — | — | |
| SCHEMBL3849729 | 0.73 | — | — | |
| SCHEMBL4272696 | 0.73 | — | — | |
| SCHEMBL7627147 | 0.71 | — | — | |
| Bromide SCHEMBL8915681 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-3887386-A1 | PEPTIDE LIGANDS FOR CAPTURE OF HOST CELL PROTEINS | North Carolina State University (US) | 2021-10-06 | — | — | EP | disclosed |
| WO-2020112906-A1 | PEPTIDE LIGANDS FOR CAPTURE OF HOST CELL PROTEIINS | NORTH CAROLINA STATE UNIVERSITY (US) | 2020-06-04 | — | — | WO | disclosed |