⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7049039 | 0.75 | GSK3A (0.35) | — | |
| SCHEMBL7044687 | 0.74 | JAK2 (0.35) | — | |
| SCHEMBL7045433 | 0.72 | PDGFRB (0.34) | — | |
| SCHEMBL7045658 | 0.72 | PDGFRB (0.34) | — | |
| SCHEMBL7042761 | 0.72 | — | — | |
| SCHEMBL6694054 | 0.72 | L3MBTL1 (0.35) | — | |
| SCHEMBL7042367 | 0.72 | — | — | |
| SCHEMBL7044698 | 0.72 | CDK2 (0.31) | — | |
| SCHEMBL7115828 | 0.70 | PRKCQ (0.36) | — | |
| SCHEMBL7047286 | 0.69 | L3MBTL1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20030130264-A1 | Methods of using pyrimidine-based antiviral agents | TULARIK INC. (US) | 2003-07-10 | — | — | US | disclosed |
| WO-2002064096-A2 | METHODS OF USING PYRIMIDINE-BASED ANTIVIRAL AGENTS | TULARIK INC. (US) | 2002-08-22 | — | — | WO | disclosed |