⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1127488 | 0.83 | — | — | |
| SCHEMBL24449384 | 0.79 | MAPK1 (0.32) | — | |
| SCHEMBL20091976 | 0.77 | DPP4 (0.41) | — | |
| SCHEMBL24448782 | 0.77 | MAPK1 (0.31) | — | |
| SCHEMBL199018 | 0.69 | — | — | |
| SCHEMBL14343050 | 0.69 | — | — | |
| SCHEMBL16152515 | 0.69 | — | — | |
| SCHEMBL23346703 | 0.68 | MAPK1 (0.32) | — | |
| SCHEMBL11083871 | 0.68 | MAPK1 (0.32) | — | |
| SCHEMBL22086828 | 0.67 | — | — |
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-2015104278-A1 | EPOXY RESIN SYSTEMS WITH PIPERIDINE DERIVATIVES AS CURING AGENTS | BASF SE (DE) | 2015-07-16 | — | — | WO | disclosed |