⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24061471 | 0.73 | CYP1B1 (0.30) | — | |
| SCHEMBL24586272 | 0.65 | AHR (0.39) | — | |
| SCHEMBL22476138 | 0.64 | — | — | |
| SCHEMBL19495024 | 0.64 | GAA (0.38) | — | |
| SCHEMBL12324273 | 0.62 | CYP1A2 (0.36) | — | |
| SCHEMBL24444808 | 0.61 | — | — | |
| SCHEMBL22060971 | 0.61 | ALOX5 (0.36) | — | |
| SCHEMBL13765095 | 0.60 | — | — | |
| SCHEMBL28789397 | 0.59 | SIGMAR1 (0.31) | — | |
| SCHEMBL10086115 | 0.57 | HSP90AA1 (0.31) | — |
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-4002509-A1 | LIGHT-EMITTING DEVICE AND ELECTRONIC APPARATUS INCLUDING THE SAME | Samsung Electronics Co., Ltd. (KR) | 2022-05-25 | — | — | EP | disclosed |