⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22456901 | 0.95 | NPSR1 (0.31) | — | |
| SCHEMBL10071338 | 0.80 | — | — | |
| SCHEMBL21095749 | 0.76 | NPSR1 (0.41) | — | |
| SCHEMBL19149741 | 0.75 | ALDH1A1 (0.35) | — | |
| SCHEMBL24191151 | 0.73 | TRPM8 (0.38) | — | |
| SCHEMBL23315073 | 0.72 | TRPM8 (0.31) | — | |
| SCHEMBL19646307 | 0.72 | ENPP2 (0.39) | — | |
| SCHEMBL22173846 | 0.70 | — | — | |
| SCHEMBL16500917 | 0.70 | SIGMAR1 (0.51) | — | |
| SCHEMBL18828278 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20200303648-A1 | ORGANIC EL LIGHT-EMITTING ELEMENT AND METHOD FOR MANUFACTURING SAME | SAKAI DISPLAY PRODUCTS CORPORATION (JP) | 2020-09-24 | — | — | US | disclosed |