⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24521176 | 0.78 | CYP1A1 (0.33) | — | |
| SCHEMBL20663634 | 0.75 | MEN1 (0.33) | — | |
| SCHEMBL24521276 | 0.74 | — | — | |
| SCHEMBL25145254 | 0.73 | LIMK1 (0.35) | — | |
| SCHEMBL24735782 | 0.71 | CYP11B1 (0.34) | — | |
| SCHEMBL24521232 | 0.70 | TDP2 (0.40) | — | |
| SCHEMBL25021429 | 0.70 | TTR (0.33) | — | |
| SCHEMBL17467291 | 0.69 | MEN1 (0.37) | — | |
| SCHEMBL17854713 | 0.68 | MEN1 (0.31) | — | |
| SCHEMBL24384305 | 0.68 | SMN1; SMN2 (0.38) | — |
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-4015515-A1 | HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME | LT Materials Co., Ltd. (KR) | 2022-06-22 | — | — | EP | disclosed |