⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30259177 | 0.76 | LMNA (0.31) | — | |
| SCHEMBL526954 | 0.73 | — | — | |
| SCHEMBL8447303 | 0.72 | — | — | |
| SCHEMBL28102228 | 0.71 | TRIM24 (0.39) | — | |
| Methane SCHEMBL28870714 | 0.71 | — | — | |
| Ethoxycarbonyl Group SCHEMBL28082089 | 0.71 | LMNA (0.33) | — | |
| SCHEMBL27857856 | 0.69 | MAPT (0.34) | — | |
| SCHEMBL27857892 | 0.69 | CDK1 (0.32) | — | |
| SCHEMBL28945973 | 0.69 | — | — | |
| SCHEMBL2888123 | 0.69 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105732594-B | Organic material and organic electroluminescent device using the same | 机光科技股份有限公司 | 2019-04-30 | — | — | CN | disclosed |
| CN-105732594-A | ORGANIC MATERIAL AND ORGANIC ELECTROLUMINESCENT DEVICE USING THE SAME | 机光科技股份有限公司 | 2016-07-06 | — | — | CN | disclosed |