⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20858549 | 0.72 | CYP1A2 (0.38) | — | |
| SCHEMBL19261611 | 0.69 | CYP1A2 (0.35) | — | |
| SCHEMBL29768240 | 0.67 | CYP1A2 (0.33) | — | |
| SCHEMBL22940624 | 0.64 | CYP1A2 (0.35) | — | |
| SCHEMBL18746416 | 0.64 | PADI4 (0.39) | — | |
| SCHEMBL24445116 | 0.63 | — | — | |
| SCHEMBL24609459 | 0.63 | KDM4E (0.30) | — | |
| SCHEMBL25132521 | 0.63 | THRB (0.33) | — | |
| SCHEMBL10783887 | 0.63 | KDM4E (0.38) | — | |
| SCHEMBL31573810 | 0.62 | — | — |
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-2020026088-A1 | LIGHT EMITTING ELEMENT, LIGHT EMITTING DEVICE, ELECTRONIC EQUIPMENT, AND ILLUMINATION DEVICE | 株式会社半導体エネルギー研究所 | 2020-02-06 | — | — | WO | disclosed |