⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1371385 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL515120 | 0.97 | — | — | |
| Hydrochloric Acid SCHEMBL515806 | 0.97 | — | — | |
| SCHEMBL625250 | 0.97 | — | — | |
| SCHEMBL15444507 | 0.95 | — | — | |
| SCHEMBL15354433 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL515400 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL515613 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL515512 | 0.92 | — | — | |
| SCHEMBL15515500 | 0.91 | OPRL1 (0.31) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9403777-B2 | Inhibitors of the influenza A virus M2 proton channel | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2016-08-02 | — | — | US | disclosed |
| US-9403777-B2 | Inhibitors of the influenza A virus M2 proton channel | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2016-08-02 | — | — | US | disclosed |
| US-20140024635-A1 | INHIBITORS OF THE INFLUENZA A VIRUS M2 PROTON CHANNEL | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2014-01-23 | — | — | US | disclosed |
| US-20140024635-A1 | INHIBITORS OF THE INFLUENZA A VIRUS M2 PROTON CHANNEL | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2014-01-23 | — | — | US | disclosed |
| US-8569284-B2 | Inhibitors of the influenza A virus M2 proton channel | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2013-10-29 | — | — | US | disclosed |
| US-8569284-B2 | Inhibitors of the influenza A virus M2 proton channel | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2013-10-29 | — | — | US | disclosed |
| US-20120028957-A1 | Inhibitors Of The Influenza A Virus M2 Proton Channel | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA | 2012-02-02 | — | — | US | disclosed |
| US-20120028957-A1 | Inhibitors Of The Influenza A Virus M2 Proton Channel | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA | 2012-02-02 | — | — | US | disclosed |