⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18948093 | 0.82 | — | — | |
| SCHEMBL7483138 | 0.75 | — | — | |
| SCHEMBL19119907 | 0.73 | — | — | |
| SCHEMBL21323997 | 0.73 | — | — | |
| SCHEMBL17286045 | 0.73 | — | — | |
| SCHEMBL16442108 | 0.73 | — | — | |
| SCHEMBL15445 | 0.71 | — | — | |
| SCHEMBL17626634 | 0.71 | TSHR (0.53) | — | |
| SCHEMBL24494946 | 0.71 | — | — | |
| SCHEMBL25477131 | 0.70 | TSHR (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3548478-B1 | PYRIMIDINE COMPOUNDS CONTAINING ACIDIC GROUPS | APROS THERAPEUTICS INC (US) | 2021-11-17 | — | — | EP | disclosed |
| US-20210349082-A1 | ANALYSIS INSTRUMENT | NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT | 2021-11-11 | — | — | US | disclosed |
| US-20180133188-A1 | WEIGHT-LOSS BEVERAGE COMPOSITION AND METHOD | MCKINNON JORDAN (CA) | 2018-05-17 | — | — | US | disclosed |