⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1844869 | 0.80 | — | — | |
| SCHEMBL1844864 | 0.80 | — | — | |
| SCHEMBL27937957 | 0.78 | — | — | |
| SCHEMBL11203616 | 0.77 | ALDH1A1 (0.42) | — | |
| SCHEMBL4526048 | 0.76 | ALDH1A1 (0.42) | — | |
| SCHEMBL3685287 | 0.74 | — | — | |
| SCHEMBL11088371 | 0.74 | — | — | |
| SCHEMBL9223745 | 0.72 | — | — | |
| SCHEMBL11325248 | 0.72 | ALDH1A1 (0.44) | — | |
| SCHEMBL3979627 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-RE30810-E | HEAT STABILIZERS FOR POLYMERS | THIOKOL CORPORATION (US) | 1981-12-01 | — | — | US | disclosed |
| US-RE30032-E | POLYMER STABILIZERS | CINCINNATI MILACRON CHEMICALS, INC. (US) | 1979-06-12 | — | — | US | disclosed |
| US-3979359-A | STABILIZERS FOR VINYL- AND VINYLIDENE HALIDE POLYMERS | CINCINNATI MILACRON CHEMICALS, INC. (US) | 1976-09-07 | — | — | US | disclosed |