⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28616833 | 0.85 | GPR119 (0.32) | — | |
| SCHEMBL30808298 | 0.85 | GPR119 (0.32) | — | |
| SCHEMBL15751094 | 0.75 | GPR35 (0.31) | — | |
| SCHEMBL30808058 | 0.74 | YTHDC1 (0.34) | — | |
| SCHEMBL21823128 | 0.74 | ALDH1A1 (0.34) | — | |
| SCHEMBL30808281 | 0.72 | PIP4K2C (0.42) | — | |
| SCHEMBL28606328 | 0.72 | PIP4K2C (0.42) | — | |
| SCHEMBL28613381 | 0.69 | PDPK1 (0.49) | — | |
| SCHEMBL12505973 | 0.68 | GPR119 (0.51) | — | |
| SCHEMBL28610278 | 0.65 | AR (0.38) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-113039182-B | Inhibitors of YAP/TAZ-TEAD interactions and their use in cancer treatment | 伊文蒂瓦公司 | 2024-02-20 | — | — | CN | disclosed |
| CN-113039182-A | Inhibitors of YAP/TAZ-TEAD interaction and their use in cancer treatment | 伊文蒂瓦公司 | 2021-06-25 | — | — | CN | disclosed |