⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7263279 | 0.81 | ALDH1A1 (0.33) | — | |
| SCHEMBL7263274 | 0.81 | ALDH1A1 (0.33) | — | |
| SCHEMBL14886943 | 0.78 | — | — | |
| SCHEMBL15774037 | 0.78 | — | — | |
| SCHEMBL16581262 | 0.76 | — | — | |
| SCHEMBL9768535 | 0.74 | ALOX15 (0.35) | — | |
| SCHEMBL30558768 | 0.74 | CES1 (0.48) | — | |
| SCHEMBL22386310 | 0.74 | — | — | |
| SCHEMBL9768533 | 0.74 | ALOX15 (0.35) | — | |
| SCHEMBL16581266 | 0.74 | CES1 (0.48) | — |
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-3822265-A1 | SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS | Bayer AG (DE) | 2021-05-19 | — | — | EP | disclosed |
| EP-3822268-A1 | SUBSTITUTED HYDANTOINAMIDES AS ADAMTS7 ANTAGONISTS | Bayer Aktiengesellschaft (DE) | 2021-05-19 | — | — | EP | disclosed |
| US-20140271765-A1 | METHODS AND DEVICE FOR TREATING OPIOID ADDICTION | TITAN PHARMACEUTICALS, INC. (US) | 2014-09-18 | — | — | US | disclosed |