⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10467309 | 0.79 | — | — | |
| SCHEMBL10357728 | 0.77 | ALDH1A1 (0.46) | — | |
| SCHEMBL11321178 | 0.72 | CYP1A2 (0.49) | — | |
| SCHEMBL3989080 | 0.71 | — | — | |
| SCHEMBL12467531 | 0.69 | TAAR1 (0.57) | — | |
| SCHEMBL14096368 | 0.69 | MIF (0.62) | — | |
| SCHEMBL11623839 | 0.68 | TAAR1 (0.60) | — | |
| SCHEMBL2872397 | 0.68 | POLB (0.58) | — | |
| SCHEMBL27283896 | 0.67 | — | — | |
| SCHEMBL1107001 | 0.67 | LMNA (0.62) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1014242-B | PREPN. OF THIADIAZOLE COMPOUNDS | LILLY CO ELI (US) | 1991-10-09 | — | — | CN | claimed |
| EP-0229501-B1 | THIADIAZOLE ANTIVIRAL AGENTS | ELI LILLY AND COMPANY (US) | 1990-12-27 | — | — | EP | claimed |
| CN-86108507-A | The thiadiazole antiviral agent | — | 1987-08-05 | — | — | CN | claimed |
| EP-0229501-A1 | Thiadiazole antiviral agents | ELI LILLY AND COMPANY (US) | 1987-07-22 | — | — | EP | claimed |
| US-20040023928-A1 | Phosphonate nucleotide and thiadiazole compounds for the treatment of smallpox | COLACINO JOSEPH MATTHEW (US) | 2004-02-05 | — | — | US | disclosed |
| US-5093324-A | Ribose-substituted | ELI LILLY AND COMPANY (US) | 1992-03-03 | — | — | US | disclosed |
| EP-0229501-B1 | THIADIAZOLE ANTIVIRAL AGENTS | ELI LILLY AND COMPANY (US) | 1990-12-27 | — | — | EP | disclosed |
| EP-0392769-A1 | Thiadiazole antiviral agents | ELI LILLY AND COMPANY (US) | 1990-10-17 | — | — | EP | disclosed |
| US-4835168-A | Thiadiazole antiviral agents | ELI LILLY AND COMPANY (US) | 1989-05-30 | — | — | US | disclosed |
| EP-0229501-A1 | Thiadiazole antiviral agents | ELI LILLY AND COMPANY (US) | 1987-07-22 | — | — | EP | disclosed |