⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10513603 | 0.92 | OPRM1 (0.48) | — | |
| SCHEMBL24920047 | 0.89 | MAPT (0.46) | — | |
| SCHEMBL20411871 | 0.89 | MAPT (0.46) | — | |
| SCHEMBL21539502 | 0.81 | — | — | |
| SCHEMBL14724919 | 0.80 | ALDH1A1 (0.39) | — | |
| SCHEMBL1470292 | 0.79 | — | — | |
| SCHEMBL16925550 | 0.78 | — | — | |
| SCHEMBL15423493 | 0.77 | LMNA (0.48) | — | |
| SCHEMBL27690588 | 0.77 | ALDH1A1 (0.40) | — | |
| SCHEMBL21467732 | 0.76 | DNM1 (0.46) | — |
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-3770166-B1 | ORGANOMETALLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE INCLUDING THE SAME | SAMSUNG ELECTRONICS CO LTD (KR) | 2021-10-06 | — | — | EP | disclosed |