⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7830363 | 0.94 | MIF (0.32) | — | |
| SCHEMBL9183340 | 0.81 | MIF (0.32) | — | |
| Chloroform SCHEMBL8308279 | 0.77 | MEN1 (0.35) | — | |
| SCHEMBL4002605 | 0.76 | LMNA (0.43) | — | |
| SCHEMBL8307759 | 0.76 | LMNA (0.35) | — | |
| Chloroform SCHEMBL8307756 | 0.73 | ALDH1A1 (0.34) | — | |
| SCHEMBL6898384 | 0.72 | MMP1 (0.32) | — | |
| SCHEMBL9183404 | 0.72 | MIF (0.32) | — | |
| SCHEMBL4739892 | 0.72 | MIF (0.32) | — | |
| Chloroform SCHEMBL8311136 | 0.72 | PRKCA (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5914339-A | ANTI-DIABETIC AND/OR ANTIHYPERGLYCEMIA AND/OR ANTI-OBESITY AGENTS | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-06-22 | — | — | US | disclosed |
| EP-0901484-A1 | SUBSTITUTED 1, 3-BENZODIOXOLES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1999-03-17 | — | — | EP | disclosed |
| WO-1997043273-A1 | SUBSTITUTED 1, 3-BENZODIOXOLES | AMERICAN HOME PRODUCTS CORPORATION (US) | 1997-11-20 | — | — | WO | disclosed |