⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27571250 | 0.72 | DCUN1D1 (0.42) | — | |
| SCHEMBL557782 | 0.70 | IDO1 (0.43) | — | |
| SCHEMBL558325 | 0.70 | IDO1 (0.42) | — | |
| SCHEMBL2650875 | 0.70 | IDO1 (0.42) | — | |
| SCHEMBL26259557 | 0.69 | IKBKE (0.32) | — | |
| SCHEMBL26259398 | 0.69 | MEN1 (0.33) | — | |
| SCHEMBL3859261 | 0.68 | IDO1 (0.47) | — | |
| SCHEMBL1501919 | 0.68 | IDO1 (0.43) | — | |
| SCHEMBL38658489 | 0.68 | IDO1 (0.47) | — | |
| SCHEMBL1501942 | 0.68 | IDO1 (0.47) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050203059-A1 | Methods and compositions for treatment of ischemia | HARRISON STEPHEN D (US) | 2005-09-15 | — | — | US | disclosed |
| EP-1317433-A2 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2003-06-11 | — | — | EP | disclosed |
| WO-2002020495-A2 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 2002-03-14 | — | — | WO | disclosed |
| EP-1087963-A1 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | Chiron Corporation (US) | 2001-04-04 | — | — | EP | disclosed |
| WO-1999065897-A1 | INHIBITORS OF GLYCOGEN SYNTHASE KINASE 3 | CHIRON CORPORATION (US) | 1999-12-23 | — | — | WO | disclosed |