⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13750191 | 0.77 | — | — | |
| SCHEMBL17072590 | 0.75 | OPRD1 (0.34) | — | |
| SCHEMBL13816235 | 0.71 | — | — | |
| SCHEMBL17072579 | 0.70 | PDK2 (0.36) | — | |
| SCHEMBL22756000 | 0.69 | OPRD1 (0.32) | — | |
| SCHEMBL15307661 | 0.68 | MAPT (0.45) | — | |
| SCHEMBL21546160 | 0.68 | KDM4E (0.30) | — | |
| SCHEMBL23790875 | 0.67 | ALDH1A1 (0.33) | — | |
| SCHEMBL24685162 | 0.66 | — | — | |
| SCHEMBL807467 | 0.61 | ALDH1A1 (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014163228-A1 | NOVEL ORGANIC ELECTROLUMINESCENT ELEMENT COMPOUND AND ORGANIC ELECTROLUMINESCENT ELEMENT COMPRISING SAME | (주)피엔에이치테크 (KR) | 2014-10-09 | — | — | WO | disclosed |