⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL191350 | 0.85 | FBP1 (1.00) | — | |
| SCHEMBL9687296 | 0.80 | — | — | |
| SCHEMBL28079135 | 0.80 | FBP1 (0.80) | — | |
| SCHEMBL28382830 | 0.78 | FBP1 (0.76) | — | |
| SCHEMBL8371244 | 0.76 | — | — | |
| SCHEMBL11445382 | 0.76 | — | — | |
| SCHEMBL11819066 | 0.74 | FBP1 (0.70) | — | |
| SCHEMBL11824120 | 0.74 | FBP1 (0.77) | — | |
| SCHEMBL11818034 | 0.74 | FBP1 (0.70) | — | |
| SCHEMBL11829207 | 0.74 | FBP1 (0.81) | — |
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-5124450-A | Reacting solution of 2-mercaptothiazole, saturated secondary heterocyclic amine, sulfur in presence of oxygen, ammonia, copper or cerium catalyst | AKZO N.V. (NL) | 1992-06-23 | — | — | US | claimed |
| US-5124450-A | Reacting solution of 2-mercaptothiazole, saturated secondary heterocyclic amine, sulfur in presence of oxygen, ammonia, copper or cerium catalyst | AKZO N.V. (NL) | 1992-06-23 | — | — | US | disclosed |