⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24810962 | 0.81 | — | — | |
| SCHEMBL21515602 | 0.64 | NUAK1 (0.30) | — | |
| SCHEMBL7559713 | 0.63 | IGF1R (0.35) | — | |
| SCHEMBL13568740 | 0.61 | MAPT (0.44) | — | |
| SCHEMBL15676352 | 0.60 | IGF1R (0.33) | — | |
| SCHEMBL10014867 | 0.60 | ALDH1A1 (0.35) | — | |
| SCHEMBL23739202 | 0.60 | BCL2 (0.34) | — | |
| SCHEMBL25496274 | 0.60 | SENP1 (0.31) | — | |
| SCHEMBL13199249 | 0.57 | IGF1R (0.35) | — | |
| SCHEMBL19650649 | 0.55 | HTT (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4219483-A1 | HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC MATERIAL LAYER | LT Materials Co., Ltd. (KR) | 2023-08-02 | — | — | EP | disclosed |