⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7374157 | 0.71 | F10 (0.32) | — | |
| SCHEMBL7407923 | 0.71 | EGFR (0.36) | — | |
| SCHEMBL7409252 | 0.69 | F10 (0.32) | — | |
| SCHEMBL7375611 | 0.68 | CDK2 (0.31) | — | |
| SCHEMBL7407384 | 0.68 | P2RX7 (0.33) | — | |
| SCHEMBL7369284 | 0.67 | F10 (0.45) | — | |
| SCHEMBL7376327 | 0.67 | F10 (0.39) | — | |
| SCHEMBL7370835 | 0.66 | F10 (0.35) | — | |
| SCHEMBL7554775 | 0.62 | F10 (0.38) | — | |
| SCHEMBL7409241 | 0.62 | F10 (0.40) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1051176-A4 | SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS | AVENTIS PHARM PROD INC (US) | 2002-06-12 | — | — | EP | disclosed |
| EP-1051176-A1 | SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS | Aventis Pharmaceuticals Products Inc. (US) | 2000-11-15 | — | — | EP | disclosed |
| WO-1999037304-A1 | SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS | AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) | 1999-07-29 | — | — | WO | disclosed |