⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19040335 | 0.83 | — | — | |
| SCHEMBL19053840 | 0.71 | PDE10A (0.31) | — | |
| SCHEMBL14752127 | 0.68 | — | — | |
| SCHEMBL26340808 | 0.68 | POLB (0.32) | — | |
| SCHEMBL23546701 | 0.68 | KDM4E (0.31) | — | |
| SCHEMBL20993428 | 0.67 | KDM5B (0.33) | — | |
| SCHEMBL14754852 | 0.66 | TSHR (0.31) | — | |
| SCHEMBL23664362 | 0.64 | MEN1 (0.31) | — | |
| SCHEMBL19040337 | 0.62 | THRB (0.31) | — | |
| SCHEMBL24415107 | 0.62 | — | — |
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-10442798-B2 | Tetrahydroquinoline sulfonamide and related compounds for use as agonists of RORγ and the treatment of disease | LYCERA CORPORATION (US) | 2019-10-15 | — | — | US | disclosed |