⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2462465 | 0.69 | — | — | |
| SCHEMBL9819016 | 0.69 | — | — | |
| SCHEMBL28861679 | 0.49 | — | — | |
| SCHEMBL131519 | 0.48 | — | — | |
| SCHEMBL17480336 | 0.48 | — | — | |
| SCHEMBL28162974 | 0.48 | ALDH1A1 (0.42) | — | |
| Water SCHEMBL28155912 | 0.46 | ALDH1A1 (0.40) | — | |
| SCHEMBL17366313 | 0.46 | — | — | |
| SCHEMBL1082024 | 0.46 | — | — | |
| SCHEMBL31573870 | 0.45 | HTR1A (0.39) | — |
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-0983304-A1 | DERMATAN DISULFATE, AN INHIBITOR OF THROMBIN GENERATION AND COMPLEMENT ACTIVATION | Dermatan Products Limited (US) | 2000-03-08 | — | — | EP | disclosed |
| WO-1998034959-A1 | DERMATAN DISULFATE, AN INHIBITOR OF THROMBIN GENERATION AND COMPLEMENT ACTIVATION | DERMATAN PRODUCTS LIMITED (US) | 1998-08-13 | — | — | WO | disclosed |