⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8508536 | 0.67 | — | — | |
| SCHEMBL19119915 | 0.67 | — | — | |
| SCHEMBL15658520 | 0.64 | RPS6KA3 (0.52) | — | |
| SCHEMBL707353 | 0.63 | — | — | |
| SCHEMBL13469386 | 0.63 | — | — | |
| SCHEMBL31652373 | 0.63 | — | — | |
| SCHEMBL25405449 | 0.62 | — | — | |
| SCHEMBL569128 | 0.62 | — | — | |
| SCHEMBL24802934 | 0.61 | CCNT1 (0.42) | — | |
| SCHEMBL8544011 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3463362-A1 | SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUNDS USEFUL AS GPR120 AGONISTS | Merck Sharp & Dohme Corp. (US) | 2019-04-10 | — | — | EP | disclosed |
| WO-2017205193-A1 | SUBSTITUTED TETRAHYDROISOQUINOLINE COMPOUNDS USEFUL AS GPR120 AGONISTS | MERCK SHARP & DOHME CORP. (US) | 2017-11-30 | — | — | WO | disclosed |