⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3369744 | 0.80 | — | — | |
| SCHEMBL4344895 | 0.78 | — | — | |
| SCHEMBL30680088 | 0.78 | — | — | |
| SCHEMBL7232241 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL28177100 | 0.77 | — | — | |
| Water SCHEMBL10730329 | 0.77 | — | — | |
| SCHEMBL27775520 | 0.76 | — | — | |
| SCHEMBL2157790 | 0.71 | — | — | |
| SCHEMBL28112307 | 0.71 | — | — | |
| Pyridine SCHEMBL28410148 | 0.67 | — | — |
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-20030158405-A1 | Chemical intermediates for making a phospholipase enzyme inhibitors | WYETH | 2003-08-21 | — | — | US | disclosed |
| EP-0610377-A1 | TRI-SUBSTITUTED TETRAHYDROFURAN ANTIFUNGALS | SCHERING CORPORATION (US) | 1994-08-17 | — | — | EP | disclosed |
| WO-1993009114-A1 | TRI-SUBSTITUTED TETRAHYDROFURAN ANTIFUNGALS | SCHERING CORPORATION (US) | 1993-05-13 | — | — | WO | disclosed |