⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1621684 | 0.86 | MAP1LC3B (0.30) | — | |
| SCHEMBL409339 | 0.78 | POLB (0.32) | — | |
| SCHEMBL2866944 | 0.74 | RIPK1 (0.30) | — | |
| SCHEMBL7974123 | 0.71 | CHRNA7 (0.33) | — | |
| SCHEMBL7974127 | 0.71 | CHRNA7 (0.33) | — | |
| SCHEMBL2353287 | 0.71 | — | — | |
| SCHEMBL2353284 | 0.71 | — | — | |
| SCHEMBL3694503 | 0.69 | — | — | |
| SCHEMBL3692508 | 0.69 | — | — | |
| SCHEMBL4552113 | 0.69 | OPRK1 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20120022046-A1 | Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections | SIGA TECHNOLOGIES, INC. | 2012-01-26 | — | — | US | claimed |
| US-20120022046-A1 | Thienopyridine Derivatives for the Treatment and Prevention of Dengue Virus Infections | SIGA TECHNOLOGIES, INC. | 2012-01-26 | — | — | US | disclosed |
| EP-2400845-A1 | THIENOPYRIDINE DERIVATIVES FOR THE TREATMENT AND PREVENTION OF DENGUE VIRUS INFECTIONS | Siga Technologies, Inc. (US) | 2012-01-04 | — | — | EP | disclosed |