⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28919266 | 0.80 | ALDH1A1 (0.45) | — | |
| SCHEMBL8018688 | 0.79 | ALDH1A1 (0.39) | — | |
| SCHEMBL12894429 | 0.77 | — | — | |
| SCHEMBL1639232 | 0.77 | — | — | |
| SCHEMBL1911322 | 0.77 | — | — | |
| SCHEMBL26033404 | 0.76 | SCN4A (0.32) | — | |
| SCHEMBL310729 | 0.76 | — | — | |
| SCHEMBL56525 | 0.76 | — | — | |
| SCHEMBL57121 | 0.76 | — | — | |
| SCHEMBL803810 | 0.75 | ALDH1A1 (0.60) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023009817-A2 | PHOSPHATE PRODRUGS OF CANNABINOIDS | EMORY UNIVERSITY (US) | 2023-02-02 | — | — | WO | disclosed |
| US-20100029670-A1 | ORGANIC COMPOUNDS | NOVARTIS AG (CH) | 2010-02-04 | — | — | US | disclosed |
| EP-1659881-A2 | NOVEL FLAVORS, FLAVOR MODIFIERS, TASTANTS, TASTE ENHANCERS, UMAMI OR SWEET TASTANTS, AND/OR ENHANCERS AND USE THEREOF | Senomyx Inc. (US) | 2006-05-31 | — | — | EP | disclosed |
| WO-2005041684-A2 | NOVEL FLAVORS, FLAVOR MODIFIERS, TASTANTS, TASTE ENHANCERS, UMAMI OR SWEET TASTANTS, AND/OR ENHANCERS AND USE THEREOF | SENOMYX INC. (US) | 2005-05-12 | — | — | WO | disclosed |