⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13547710 | 0.84 | RAPGEF4 (0.32) | — | |
| SCHEMBL22618062 | 0.84 | — | — | |
| SCHEMBL14535948 | 0.78 | — | — | |
| SCHEMBL13547715 | 0.77 | RAPGEF4 (0.39) | — | |
| SCHEMBL9109691 | 0.73 | — | — | |
| SCHEMBL19446695 | 0.72 | — | — | |
| SCHEMBL14394789 | 0.72 | CA1 (0.43) | — | |
| SCHEMBL14424602 | 0.71 | — | — | |
| SCHEMBL27855626 | 0.71 | — | — | |
| SCHEMBL13083355 | 0.70 | ACHE (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20200251662-A1 | THERMALLY ACTIVATED DELAYED FLUORESCENCE MATERIAL, ORGANIC ELECTROLUMINESCENT DEVICE, AND DISPLAY PANEL | Wuhan China Star Optoelectronics Semicondutor Display Technology Co., Ltd. (CN) | 2020-08-06 | — | — | US | disclosed |
| EP-1787992-A1 | Pyrrolopyrimidine and pyrrolopyridine derivatives substituted with cyclic amino group | TAISHO PHARMACEUTICAL CO., LTD (JP) | 2007-05-23 | — | — | EP | disclosed |