⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27804896 | 0.77 | — | — | |
| SCHEMBL28097242 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL32665762 | 0.76 | TSHR (0.32) | — | |
| SCHEMBL31757601 | 0.75 | — | — | |
| SCHEMBL27865066 | 0.74 | — | — | |
| SCHEMBL28110616 | 0.74 | TSHR (0.31) | — | |
| SCHEMBL28405724 | 0.73 | POLA1 (0.32) | — | |
| SCHEMBL30287341 | 0.73 | — | — | |
| SCHEMBL29066699 | 0.73 | — | — | |
| SCHEMBL27531486 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023075696-A2 | METHOD FOR PREPARING A POLYMER HAVING ESTER FUNCTIONALITY AND SAID POLYMER PREPARED THEREFROM | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2023-05-04 | — | — | WO | disclosed |
| US-5350675-A | Multilayer analytical element for determination of total cholesterol in blood | FUJI PHOTO FILM CO., LTD. (JP) | 1994-09-27 | — | — | US | disclosed |