⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9384476 | 0.67 | — | — | |
| SCHEMBL16799434 | 0.67 | KDM4A (0.40) | — | |
| SCHEMBL9316319 | 0.67 | PTK2 (0.42) | — | |
| SCHEMBL5333405 | 0.67 | FYN (0.37) | — | |
| SCHEMBL28450892 | 0.67 | KMO (0.34) | — | |
| SCHEMBL9454820 | 0.67 | SCN9A (0.33) | — | |
| SCHEMBL536974 | 0.64 | KDM4E (0.56) | — | |
| SCHEMBL1830802 | 0.64 | CYP1A2 (0.36) | — | |
| SCHEMBL2786850 | 0.64 | — | — | |
| SCHEMBL718110 | 0.64 | CYP1A2 (0.34) | — |
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-3169332-A1 | FOOD INTAKE, BODY WEIGHT AND GLUCOSE METABOLISM REGULATION BY MODULATION OF P2Y6 RECEPTOR SIGNALING | Max-Planck-Gesellschaft zur Förderung der Wissenschaften (DE) | 2017-05-24 | — | — | EP | disclosed |
| WO-2016008603-A1 | FOOD INTAKE, BODY WEIGHT AND GLUCOSE METABOLISM REGULATION BY MODULATION OF P2Y6 RECEPTOR SIGNALING | MAX-PLANCK-Gesellschaft zur Förderung der Wissenschaften e.V. (DE) | 2016-01-21 | — | — | WO | disclosed |