⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1755398 | 0.61 | — | — | |
| SCHEMBL20124795 | 0.60 | — | — | |
| SCHEMBL1755100 | 0.60 | — | — | |
| SCHEMBL16748840 | 0.58 | — | — | |
| SCHEMBL3884483 | 0.55 | — | — | |
| SCHEMBL22016264 | 0.51 | — | — | |
| SCHEMBL10357223 | 0.49 | — | — | |
| SCHEMBL25001630 | 0.47 | KDM4E (0.41) | — | |
| SCHEMBL7221897 | 0.47 | — | — | |
| SCHEMBL18803572 | 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-3162806-A2 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | Heesung Material Ltd. (KR) | 2017-05-03 | — | — | EP | disclosed |