⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2762032 | 1.00 | — | — | |
| SCHEMBL1029264 | 1.00 | — | — | |
| SCHEMBL1040949 | 0.78 | — | — | |
| SCHEMBL3734197 | 0.78 | — | — | |
| SCHEMBL19514784 | 0.74 | — | — | |
| SCHEMBL270893 | 0.73 | — | — | |
| SCHEMBL6037216 | 0.72 | TDP1 (0.35) | — | |
| SCHEMBL181898 | 0.69 | — | — | |
| SCHEMBL2427812 | 0.69 | — | — | |
| SCHEMBL61261 | 0.69 | — | — |
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-1711622-A2 | GENETIC POLYMORPHISMS ASSOCIATED WITH CARDIOVASCULAR DISORDERS AND DRUG RESPONSE, METHODS OF DETECTION AND USES THEREOF | Applera Corporation (US) | 2006-10-18 | — | — | EP | disclosed |
| WO-2005056837-A2 | GENETIC POLYMORPHISMS ASSOCIATED WITH CARDIOVASCULAR DISORDERS AND DRUG RESPONSE, METHODS OF DETECTION AND USES THEREOF | APPLERA CORPORATION (US) | 2005-06-23 | — | — | WO | disclosed |