⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3068428 | 0.78 | — | — | |
| SCHEMBL11104438 | 0.74 | KMT2A (0.38) | — | |
| SCHEMBL11104026 | 0.73 | — | — | |
| SCHEMBL11099671 | 0.72 | TAAR1 (0.33) | — | |
| SCHEMBL11099586 | 0.72 | CNR1 (0.32) | — | |
| SCHEMBL3499897 | 0.70 | — | — | |
| SCHEMBL11107959 | 0.69 | KMT2A (0.32) | — | |
| SCHEMBL11099538 | 0.69 | — | — | |
| SCHEMBL821227 | 0.68 | — | — | |
| SCHEMBL11100567 | 0.68 | — | — |
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-4477442-A | PENTOFURANOSYL-5,6-DIHYDROTRIAZINES IN TREATMENT OF VIRAL DISEASES | THE UPJOHN COMPANY (US) | 1984-10-16 | — | — | US | disclosed |
| US-4423212-A | Nucleosides and process | THE UPJOHN COMPANY (US) | 1983-12-27 | — | — | US | disclosed |
| US-4239753-A | Composition of matter and process | THE UPJOHN COMPANY (US) | 1980-12-16 | — | — | US | disclosed |
| US-4171431-A | Nucleosides and process | THE UPJOHN COMPANY (US) | 1979-10-16 | — | — | US | disclosed |