⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29808152 | 0.76 | — | — | |
| SCHEMBL4142846 | 0.68 | TSHR (0.34) | — | |
| SCHEMBL20504145 | 0.67 | TSHR (0.35) | — | |
| SCHEMBL10882059 | 0.67 | TSHR (0.32) | — | |
| SCHEMBL10033964 | 0.65 | TSHR (0.30) | — | |
| SCHEMBL2278365 | 0.62 | TSHR (0.39) | — | |
| SCHEMBL3661697 | 0.62 | TSHR (0.31) | — | |
| Hydrochloric Acid SCHEMBL28786648 | 0.60 | TSHR (0.30) | — | |
| Water SCHEMBL28135120 | 0.60 | TSHR (0.38) | — | |
| SCHEMBL11658870 | 0.59 | TSHR (0.31) | — |
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-110739404-B | Quantum dot light-emitting diode and preparation method thereof | TCL科技集团股份有限公司 | 2021-04-02 | — | — | CN | claimed |
| CN-110739404-B | Quantum dot light-emitting diode and preparation method thereof | TCL科技集团股份有限公司 | 2021-04-02 | — | — | CN | disclosed |