⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19604581 | 0.86 | — | — | |
| SCHEMBL14330274 | 0.81 | TSHR (0.30) | — | |
| SCHEMBL10050846 | 0.79 | — | — | |
| SCHEMBL14234081 | 0.79 | — | — | |
| SCHEMBL21560894 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL20143615 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL15417665 | 0.72 | — | — | |
| SCHEMBL17874843 | 0.72 | GAA (0.31) | — | |
| SCHEMBL12649806 | 0.70 | — | — | |
| SCHEMBL7967673 | 0.70 | TSHR (0.30) | — |
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-3061470-B1 | METAL MEDICAL DEVICE HAVING LUBRICITY AND LOW PROTEIN ADSORPTION PROPERTIES AND/OR LOW CELL ADSORPTION PROPERTIES, AND METHOD FOR PRODUCING SAME | SUMITOMO RUBBER IND (JP) | 2020-12-16 | — | — | EP | disclosed |
| EP-2446907-B1 | Side-chain crystallizable polymers for medical applications | REVA MEDICAL INC (US) | 2017-09-20 | — | — | EP | disclosed |