⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7638772 | 0.76 | — | — | |
| SCHEMBL8674398 | 0.72 | — | — | |
| SCHEMBL5820548 | 0.69 | — | — | |
| SCHEMBL6757124 | 0.68 | — | — | |
| SCHEMBL11816700 | 0.67 | — | — | |
| SCHEMBL6280178 | 0.65 | — | — | |
| SCHEMBL18032691 | 0.65 | GSK3A (0.30) | — | |
| SCHEMBL4243461 | 0.64 | ALDH1A1 (0.30) | — | |
| SCHEMBL15057338 | 0.63 | PLA2G7 (0.30) | — | |
| Carbon Monoxide SCHEMBL9902010 | 0.62 | — | — |
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-1353928-B1 | PROCESS FOR PREPARING CLOPIDOGREL | CADILA HEALTHCARE LTD (IN) | 2006-12-27 | — | — | EP | disclosed |
| WO-2006046733-A1 | THIOL COMPOUND, AND PHOTOSENSITIVE COMPOSITION AND BLACK MATRIX RESIST COMPOSITION USING THE COMPOUND | SHOWA DENKO K.K (JP) | 2006-05-04 | — | — | WO | disclosed |