⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18743006 | 0.78 | — | — | |
| SCHEMBL24030656 | 0.77 | — | — | |
| SCHEMBL19780045 | 0.76 | — | — | |
| SCHEMBL26068037 | 0.74 | — | — | |
| SCHEMBL22097950 | 0.74 | — | — | |
| SCHEMBL24010515 | 0.74 | MCL1 (0.31) | — | |
| SCHEMBL23157811 | 0.74 | ZDHHC20 (0.31) | — | |
| SCHEMBL19780043 | 0.71 | — | — | |
| SCHEMBL22920106 | 0.71 | CYP2D6 (0.37) | — | |
| SCHEMBL24165221 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023122780-A9 | 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD | THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2023-11-30 | — | — | WO | disclosed |
| WO-2023122780-A2 | 2-PYRAZOLE ANILINES AND RELATED ANALOGS FOR INHIBITING YAP/TAZ-TEAD | THE KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2023-06-29 | — | — | WO | disclosed |