⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15691229 | 1.00 | — | — | |
| SCHEMBL3844100 | 0.80 | — | — | |
| SCHEMBL22618865 | 0.76 | — | — | |
| SCHEMBL3846314 | 0.75 | — | — | |
| SCHEMBL19262300 | 0.74 | — | — | |
| SCHEMBL21878549 | 0.74 | — | — | |
| SCHEMBL21880230 | 0.72 | — | — | |
| SCHEMBL21877566 | 0.71 | — | — | |
| SCHEMBL21878553 | 0.70 | PGK1 (0.31) | — | |
| SCHEMBL8735265 | 0.70 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9737493-B2 | Compositions and methods for modulating DNMT1 inhibitor activity | UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) | 2017-08-22 | — | — | US | disclosed |
| US-9737493-B2 | Compositions and methods for modulating DNMT1 inhibitor activity | UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. (US) | 2017-08-22 | — | — | US | disclosed |
| US-20150238439-A1 | COMPOSITIONS AND METHODS FOR MODULATING DNMT1 INHIBITOR ACTIVITY | UNIVERSITY OF LOUISVILLE RESEARCH FOUNDATION, INC. | 2015-08-27 | — | — | US | disclosed |
| EP-2567950-A1 | Substituted alkine derivatives as anti-cancer agents | University Of Louisville Research Foundation, Inc. (US) | 2013-03-13 | — | — | EP | disclosed |