⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11117145 | 0.87 | ALDH1A1 (0.32) | — | |
| SCHEMBL25660516 | 0.78 | SLC1A2 (0.39) | — | |
| SCHEMBL14693847 | 0.78 | SLC1A2 (0.39) | — | |
| SCHEMBL9356942 | 0.78 | EPHX1 (0.33) | — | |
| SCHEMBL16977455 | 0.78 | SLC1A2 (0.39) | — | |
| SCHEMBL16977450 | 0.78 | GABRA1 (0.33) | — | |
| SCHEMBL25660337 | 0.78 | SLC1A2 (0.39) | — | |
| SCHEMBL8270998 | 0.78 | SLC1A2 (0.39) | — | |
| SCHEMBL22235721 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL16968617 | 0.77 | SLC1A2 (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 |
|---|---|---|---|---|---|---|---|
| US-5276169-A | Antimycotic carbonyl- and amino-substituted tetrahydrofurans | BAYER AKTIENGESELLSCHAFT (DE) | 1994-01-04 | — | — | US | disclosed |
| EP-0538688-A1 | Substituted tetrahydrofurans, methods for their preparation, and their use as pharmaceutical compositions | BAYER AG (DE) | 1993-04-28 | — | — | EP | disclosed |