⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9555113 | 0.78 | — | — | |
| SCHEMBL15796672 | 0.76 | — | — | |
| SCHEMBL7712971 | 0.72 | — | — | |
| SCHEMBL11459463 | 0.72 | FAAH (0.31) | — | |
| SCHEMBL9458196 | 0.72 | TSHR (0.39) | — | |
| SCHEMBL869206 | 0.69 | — | — | |
| SCHEMBL869584 | 0.69 | — | — | |
| SCHEMBL8758794 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL7712977 | 0.67 | — | — | |
| SCHEMBL13212030 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7625917-B2 | S-o-(phenylaminocarbonyl)phenyl-substituted, especially with a quaternary onium group; enhanced antiviral activity and better reactivity with zinc finger moieties, particularly, the zinc finger on HIV-1's NCp7 nucleocapsid protein | TURPIN JAMES A | 2009-12-01 | — | — | US | disclosed |
| US-20040132785-A1 | Thiolesters and uses thereof | The Government of the U. S.of America as Represented by The Sec. of Health and Human Svc. (US) | 2004-07-08 | — | — | US | disclosed |
| US-6706729-B1 | A METHOD FOR DISSOCIATING A METAL ION FROM A ZINC FINGER-CONTAINING PROTEIN; INHIBITING VIRUS | THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES | 2004-03-16 | — | — | US | disclosed |