⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20756568 | 0.65 | — | — | |
| SCHEMBL21088139 | 0.54 | — | — | |
| SCHEMBL17054202 | 0.53 | — | — | |
| SCHEMBL10282944 | 0.53 | — | — | |
| SCHEMBL20759357 | 0.52 | — | — | |
| SCHEMBL15870591 | 0.51 | ABCG2 (0.30) | — | |
| SCHEMBL15372425 | 0.47 | — | — | |
| SCHEMBL24224362 | 0.47 | — | — | |
| SCHEMBL14024467 | 0.47 | — | — | |
| SCHEMBL22881767 | 0.46 | — | — |
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-2020102443-A1 | BIASED NMDA RECEPTOR MODULATORS AND USES THEREOF | EDWARD Via COLLEGE OF OSTEOPATHIC MEDICINE (US) | 2020-05-22 | — | — | WO | disclosed |