⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1253185 | 0.82 | TSHR (0.43) | — | |
| SCHEMBL185754 | 0.82 | TSHR (0.43) | — | |
| SCHEMBL2939029 | 0.73 | TSHR (0.35) | — | |
| SCHEMBL2939027 | 0.73 | TSHR (0.35) | — | |
| SCHEMBL1100524 | 0.72 | — | — | |
| SCHEMBL17427567 | 0.71 | — | — | |
| SCHEMBL1679016 | 0.69 | — | — | |
| SCHEMBL16800255 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL11679488 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL11679490 | 0.69 | TSHR (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 |
|---|---|---|---|---|---|---|---|
| WO-2021127301-A1 | 4-PHENYL-N-(PHENYL)THIAZOL-2-AMINE DERIVATIVES AND RELATED COMPOUNDS AS ARYL HYDROCARBON RECEPTOR (AHR) AGONISTS FOR THE TREATMENT OF E.G. ANGIOGENESIS IMPLICATED OR INFLAMMATORY DISORDERS | Ikena Oncology, Inc. (US) | 2021-06-24 | — | — | WO | disclosed |