⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7863807 | 0.72 | — | — | |
| SCHEMBL6978018 | 0.67 | — | — | |
| SCHEMBL7873098 | 0.63 | — | — | |
| SCHEMBL7869449 | 0.61 | — | — | |
| SCHEMBL6956887 | 0.60 | — | — | |
| SCHEMBL99121 | 0.60 | — | — | |
| SCHEMBL6950147 | 0.60 | — | — | |
| SCHEMBL5613612 | 0.59 | — | — | |
| SCHEMBL1767192 | 0.59 | — | — | |
| SCHEMBL1551889 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1836165-A4 | DIPYRROLE COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING CANCER OR VIRAL DISEASES | GEMIN X PHARMACEUTICALS CANADA (CA) | 2009-07-08 | — | — | EP | disclosed |
| EP-1836165-A1 | DIPYRROLE COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING CANCER OR VIRAL DISEASES | Gemin X Biotechnologies Inc. (CA) | 2007-09-26 | — | — | EP | disclosed |
| WO-2006069441-A1 | DIPYRROLE COMPOUNDS, COMPOSITIONS, AND METHODS FOR TREATING CANCER OR VIRAL DISEASES | GEMIN X BIOTECHNOLOGIES INC. (CA) | 2006-07-06 | — | — | WO | disclosed |