⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4459825 | 0.68 | — | — | |
| SCHEMBL5314474 | 0.57 | — | — | |
| SCHEMBL28900007 | 0.48 | — | — | |
| SCHEMBL21680871 | 0.45 | — | — | |
| Ethoxycarbonyl Group SCHEMBL28100892 | 0.44 | SMN1; SMN2 (0.34) | — | |
| SCHEMBL1492457 | 0.44 | — | — | |
| SCHEMBL14867197 | 0.44 | — | — | |
| SCHEMBL6062101 | 0.44 | ALDH1A1 (0.39) | — | |
| SCHEMBL9013443 | 0.43 | CYP3A4 (0.55) | — | |
| Alcohol SCHEMBL17923098 | 0.43 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1836183-A2 | SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS | Galileo Pharmaceuticals, Inc. (US) | 2007-09-26 | — | — | EP | disclosed |
| WO-2006065686-A2 | SPIRO DERIVATIVES AS LIPOXYGENASE INHIBITORS | GALILEO PHARMACEUTICALS, INC. (US) | 2006-06-22 | — | — | WO | disclosed |