⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11555339 | 0.77 | — | — | |
| SCHEMBL12261418 | 0.72 | — | — | |
| SCHEMBL22872710 | 0.71 | — | — | |
| SCHEMBL2920884 | 0.70 | — | — | |
| SCHEMBL6618896 | 0.70 | — | — | |
| SCHEMBL4044697 | 0.70 | — | — | |
| SCHEMBL13454973 | 0.70 | — | — | |
| SCHEMBL404105 | 0.69 | — | — | |
| SCHEMBL16814812 | 0.67 | — | — | |
| SCHEMBL15094372 | 0.67 | — | — |
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-1183023-A1 | USE OF VERAPAMIL AND VERAPAMIL DERIVATIVES FOR PRODUCING MEDICAMENTS WITH AN INHIBITING EFFECT ON BETA-GLUCURONIDASE IN HUMAN TISSUE | PAZ ARZNEIMITTEL- ENTWICKLUNGSGESELLSCHAFT MBH (DE) | 2002-03-06 | — | — | EP | disclosed |
| WO-2000074670-A1 | USE OF VERAPAMIL AND VERAPAMIL DERIVATIVES FOR PRODUCING MEDICAMENTS WITH AN INHIBITING EFFECT ON β-GLUCURONIDASE IN HUMAN TISSUE | PAZ ARZNEIMITTEL-ENTWICKLUNGS GESELLSCHAFT MBH (DE) | 2000-12-14 | — | — | WO | disclosed |