⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9504424 | 0.79 | TSHR (0.43) | — | |
| SCHEMBL2879034 | 0.77 | TSHR (0.53) | — | |
| SCHEMBL1054362 | 0.74 | — | — | |
| SCHEMBL4141599 | 0.74 | TSHR (0.50) | — | |
| SCHEMBL29776859 | 0.74 | — | — | |
| SCHEMBL10631467 | 0.74 | TSHR (0.43) | — | |
| SCHEMBL17422598 | 0.74 | ACHE (0.38) | — | |
| SCHEMBL18860810 | 0.72 | — | — | |
| SCHEMBL6114402 | 0.72 | — | — | |
| SCHEMBL706967 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114551737-A | Method for forming hole injection layer and hole injection layer ink composition | 三星显示有限公司 | 2022-05-27 | — | — | CN | disclosed |
| CN-113745386-A | Light emitting device and method of manufacturing the same | 三星显示有限公司 | 2021-12-03 | — | — | CN | disclosed |
| CN-1577123-A | Magnetic toner | CANON KK (JP) | 2005-02-09 | — | — | CN | disclosed |
| EP-0551771-A2 | Process for producing polysilanes | NIPPON OIL CO. LTD. (JP) | 1993-07-21 | — | — | EP | disclosed |