⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23970060 | 0.72 | — | — | |
| SCHEMBL22000271 | 0.69 | — | — | |
| SCHEMBL10717071 | 0.65 | — | — | |
| SCHEMBL13750027 | 0.65 | — | — | |
| SCHEMBL14845931 | 0.64 | — | — | |
| SCHEMBL18756760 | 0.64 | PARP1 (0.30) | — | |
| SCHEMBL18117237 | 0.62 | — | — | |
| SCHEMBL19983207 | 0.61 | — | — | |
| SCHEMBL13768443 | 0.61 | — | — | |
| SCHEMBL16230233 | 0.61 | — | — |
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-2009084737-A1 | COMPOUND HAVING ACTIVITY TO SUPPRESS DEGRANULATION AND CYTOKINE PRODUCTION AND USE THEREOF | INTERPROTEIN CORPORATION (JP) | 2009-07-09 | — | — | WO | disclosed |