⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14905891 | 0.80 | — | — | |
| SCHEMBL3143437 | 0.80 | — | — | |
| SCHEMBL29087151 | 0.78 | — | — | |
| SCHEMBL4062968 | 0.78 | — | — | |
| SCHEMBL2050872 | 0.78 | — | — | |
| SCHEMBL22771465 | 0.78 | — | — | |
| SCHEMBL18068301 | 0.77 | AR (0.31) | — | |
| SCHEMBL11697415 | 0.77 | AR (0.31) | — | |
| SCHEMBL18068300 | 0.77 | AR (0.31) | — | |
| SCHEMBL2031105 | 0.77 | CCNC (0.33) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024137607-A1 | THIADIAZOLE DERIVATIVES AS INHIBITORS OF CYCLIC GMP-AMP SYNTHASE AND USES THEREOF | VENTUS THERAPEUTICS U.S., INC. (US) | 2024-06-27 | — | — | WO | disclosed |