⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23637500 | 0.88 | KDM4E (0.35) | — | |
| SCHEMBL23637422 | 0.75 | PDK2 (0.36) | — | |
| SCHEMBL23637487 | 0.74 | KDM4E (0.36) | — | |
| SCHEMBL437570 | 0.73 | ALOX5 (0.42) | — | |
| SCHEMBL23637494 | 0.72 | KDM4E (0.35) | — | |
| SCHEMBL438594 | 0.71 | PARP14 (0.46) | — | |
| SCHEMBL440562 | 0.70 | PARP14 (0.45) | — | |
| SCHEMBL23637435 | 0.69 | ALOX5 (0.38) | — | |
| SCHEMBL23637312 | 0.69 | DHFR (0.34) | — | |
| SCHEMBL22146802 | 0.68 | ALOX5 (0.45) | — |
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-2021141356-A1 | COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING SAME, AND ELECTRONIC DEVICE THEREOF | 덕산네오룩스 주식회사 | 2021-07-15 | — | — | WO | disclosed |