⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1678571 | 0.72 | FDPS (0.38) | — | |
| Ammonia Solution, Strong SCHEMBL11113280 | 0.70 | FDPS (0.36) | — | |
| SCHEMBL193494 | 0.67 | — | — | |
| SCHEMBL27522549 | 0.66 | FDPS (0.36) | — | |
| Ammonia Solution, Strong SCHEMBL6047554 | 0.65 | FDPS (0.36) | — | |
| Iodide SCHEMBL6470624 | 0.65 | FDPS (0.36) | — | |
| Bromide SCHEMBL11761277 | 0.65 | FDPS (0.36) | — | |
| Iodide SCHEMBL7849929 | 0.65 | FDPS (0.36) | — | |
| Iodide SCHEMBL6470625 | 0.65 | FDPS (0.36) | — | |
| Hydrochloric Acid SCHEMBL28030431 | 0.65 | FDPS (0.36) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020191227-A1 | METHODS FOR CONTROLLING PROSTAGLANDIN-MEDIATED BIOLOGICAL PROCESSES | CORNELL UNIVERSITY (US) | 2020-09-24 | — | — | WO | disclosed |