⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22645832 | 0.85 | GPR84 (0.33) | — | |
| SCHEMBL22649779 | 0.84 | ALDH1A1 (0.35) | — | |
| SCHEMBL22649818 | 0.81 | — | — | |
| SCHEMBL21842839 | 0.81 | — | — | |
| SCHEMBL21842842 | 0.81 | KDM4E (0.31) | — | |
| SCHEMBL21473487 | 0.79 | — | — | |
| SCHEMBL22649815 | 0.77 | — | — | |
| SCHEMBL22645835 | 0.75 | CYP1A2 (0.33) | — | |
| SCHEMBL21472583 | 0.75 | — | — | |
| SCHEMBL21230881 | 0.74 | GPR84 (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 |
|---|---|---|---|---|---|---|---|
| WO-2021155267-A2 | MRNAS ENCODING METABOLIC REPROGRAMMING POLYPEPTIDES AND USES THEREOF | MODERNATX, INC. (US) | 2021-08-05 | — | — | WO | disclosed |