⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1373465 | 0.71 | TSHR (0.30) | — | |
| SCHEMBL17541900 | 0.71 | — | — | |
| SCHEMBL15285129 | 0.69 | — | — | |
| SCHEMBL445289 | 0.67 | HSD11B1 (0.31) | — | |
| SCHEMBL16414902 | 0.61 | — | — | |
| SCHEMBL3465700 | 0.58 | — | — | |
| SCHEMBL710332 | 0.56 | — | — | |
| SCHEMBL1296320 | 0.56 | — | — | |
| SCHEMBL5665559 | 0.55 | — | — | |
| SCHEMBL1414001 | 0.54 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-10237076-A | — | — | None | — | — | JP | disclosed |
| JP-H10237076-A | LIQUID CRYSTALLINE COMPOUND HAVING MINUS ANISOTROPIC VALUE OF DIELECTRIC CONSTANT, LIQUID CRYSTAL COMPOSITION CONTAINING THE SAME LIQUID CRYSTALLINE COMPOUND AND LIQUID CRYSTAL DISPLAY ELEMENT USING THE SAME LIQUID CRYSTAL COMPOSITION | CHISSO CORP | 1998-09-08 | — | — | JP | disclosed |