⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6242458 | 0.75 | TSHR (0.44) | — | |
| SCHEMBL6780503 | 0.69 | — | — | |
| SCHEMBL21848148 | 0.69 | TSHR (0.37) | — | |
| SCHEMBL8321446 | 0.65 | — | — | |
| SCHEMBL18968461 | 0.65 | — | — | |
| Boric Acid SCHEMBL28380257 | 0.65 | TSHR (0.39) | — | |
| SCHEMBL28131506 | 0.63 | TSHR (0.44) | — | |
| Methyl Alcohol SCHEMBL8043491 | 0.61 | TSHR (0.80) | — | |
| Hydrogen Peroxide SCHEMBL2635895 | 0.61 | TSHR (0.80) | — | |
| SCHEMBL10654485 | 0.60 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115776891-A | STAT degradants and uses thereof | 凯麦拉医疗公司 | 2023-03-10 | — | — | CN | disclosed |
| EP-1093453-A1 | NAALADASE INHIBITORS USEFUL AS PHARMACEUTICAL COMPOUNDS AND COMPOSITIONS | GUILFORD PHARMACEUTICALS INC. (US) | 2001-04-25 | — | — | EP | disclosed |
| WO-2000001668-A2 | NAALADASE INHIBITORS USEFUL AS PHARMACEUTICAL COMPOUNDS AND COMPOSITIONS | GUILFORD PHARMACEUTICALS INC. (US) | 2000-01-13 | — | — | WO | disclosed |