⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3078279 | 0.76 | — | — | |
| SCHEMBL6033539 | 0.73 | — | — | |
| SCHEMBL3074779 | 0.73 | — | — | |
| SCHEMBL27504997 | 0.71 | — | — | |
| SCHEMBL3437138 | 0.69 | — | — | |
| SCHEMBL329850 | 0.69 | — | — | |
| SCHEMBL28275356 | 0.69 | — | — | |
| SCHEMBL1551404 | 0.67 | — | — | |
| Iodide SCHEMBL31261479 | 0.67 | — | — | |
| SCHEMBL6810646 | 0.65 | — | — |
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-20100179201-A1 | NOVEL THIAZOLE-BASED COMPOUND AND INHIBITOR OF T-TYPE CALCIUM CHANNEL CONTAINING THE SAME | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2010-07-15 | — | — | US | disclosed |
| US-20100179201-A1 | NOVEL THIAZOLE-BASED COMPOUND AND INHIBITOR OF T-TYPE CALCIUM CHANNEL CONTAINING THE SAME | KOREA INSTITUTE OF SCIENCE AND TECHNOLOGY (KR) | 2010-07-15 | — | — | US | disclosed |