⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9047871 | 1.00 | — | — | |
| SCHEMBL8651378 | 0.87 | ALDH1A1 (0.33) | — | |
| SCHEMBL9912688 | 0.80 | — | — | |
| SCHEMBL19250556 | 0.80 | — | — | |
| SCHEMBL17127004 | 0.79 | GNAI3 (0.32) | — | |
| SCHEMBL29766163 | 0.76 | — | — | |
| SCHEMBL31465584 | 0.76 | — | — | |
| SCHEMBL7030251 | 0.75 | ADH1B (0.32) | — | |
| SCHEMBL1164127 | 0.75 | — | — | |
| SCHEMBL6062449 | 0.74 | POLB (0.32) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0540673-B1 | ACETYLENE DERIVATIVES HAVING LIPOXYGENASE INHIBITORY ACTIVITY | ABBOTT LAB (US) | 1996-10-16 | — | — | EP | disclosed |
| US-5559144-A | LIPOXYGENASE INHIBITORS, INHIBITORS OF BIOSYNTHESIS OF LEUKOTRIENES | ABBOTT LABORATORIES (US) | 1996-09-24 | — | — | US | disclosed |
| US-5476873-A | Inhibit biosynthesis of leukotrienes | ABBOTT LABORATORIES (US) | 1995-12-19 | — | — | US | disclosed |
| US-5326787-A | Cycloalkyl N-hydroxy derivatives having lipoxygenase inhibitory activity | ABBOTT LABORATORIES (US) | 1994-07-05 | — | — | US | disclosed |