⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13369018 | 0.80 | GRM4 (0.31) | — | |
| SCHEMBL4482423 | 0.79 | — | — | |
| SCHEMBL21256197 | 0.76 | — | — | |
| SCHEMBL21499723 | 0.74 | — | — | |
| SCHEMBL22504003 | 0.73 | ADRB2 (0.30) | — | |
| SCHEMBL24116288 | 0.71 | — | — | |
| SCHEMBL26596811 | 0.71 | — | — | |
| SCHEMBL20007589 | 0.70 | — | — | |
| SCHEMBL16077745 | 0.70 | — | — | |
| SCHEMBL14300599 | 0.70 | — | — |
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-2021016575-A1 | CRYOPROTECTANT POLYMERS AND METHODS OF MAKING AND USING THEREOF | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2021-01-28 | — | — | WO | disclosed |