⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22734012 | 0.88 | GNAI3 (0.32) | — | |
| SCHEMBL22856650 | 0.77 | GNAO1 (0.40) | — | |
| SCHEMBL23346660 | 0.77 | GNAO1 (0.40) | — | |
| SCHEMBL24916476 | 0.77 | GNAO1 (0.40) | — | |
| SCHEMBL8205709 | 0.76 | SIGMAR1 (0.32) | — | |
| SCHEMBL24908399 | 0.74 | GNAO1 (0.41) | — | |
| SCHEMBL15979336 | 0.74 | — | — | |
| SCHEMBL21214226 | 0.73 | GNAO1 (0.43) | — | |
| SCHEMBL22733588 | 0.73 | GNAO1 (0.43) | — | |
| SCHEMBL23346663 | 0.72 | CYP2B6 (0.32) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140243292-A1 | SUBSITUTED 2-(CHROMAN-6-YLOXYL)-THIAZOLES AND THEIR USE AS PHARMACEUTICALS | SANOFI (FR) | 2014-08-28 | — | — | US | disclosed |