⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6213901 | 1.00 | — | — | |
| SCHEMBL5813463 | 0.94 | — | — | |
| SCHEMBL9848818 | 0.94 | — | — | |
| SCHEMBL28392468 | 0.92 | TSHR (0.48) | — | |
| SCHEMBL2576201 | 0.92 | TSHR (0.48) | — | |
| SCHEMBL4158999 | 0.92 | TSHR (0.48) | — | |
| SCHEMBL7293672 | 0.92 | TSHR (0.48) | — | |
| SCHEMBL7293885 | 0.92 | TSHR (0.48) | — | |
| SCHEMBL6586936 | 0.92 | TSHR (0.48) | — | |
| SCHEMBL15279048 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0858474-B1 | LIQUID CRYSTAL POLYMERS | SECR DEFENCE (GB) | 2000-04-26 | — | — | EP | disclosed |
| US-6030668-A | CYCLIC POLYMERS OF GIVEN FORMULA MADE FROM SUBSTITUTED DIENES HAVING MESOGENIC GROUPS FOR USE IN LIQUID CRYSTAL DEVICES, PIEZOELECTRIC DEVICES, PYROELECTRIC DEVICES AND OPTICAL RECORDING MEDIA | THE SECRETARY OF STATE FOR DEFENCE, IN HER BRITANNIC MAJESTY'S GOVERNMENT OF THE UNITED KINGDOM OF GREAT BRITAIN AND NORTHERN IRELAND (GB) | 2000-02-29 | — | — | US | disclosed |