⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11680446 | 1.00 | — | — | |
| SCHEMBL11485987 | 0.71 | ALDH1A1 (0.51) | — | |
| SCHEMBL8550068 | 0.70 | ALDH1A1 (0.37) | — | |
| SCHEMBL8550065 | 0.70 | ALDH1A1 (0.37) | — | |
| SCHEMBL9765865 | 0.58 | TDP1 (0.46) | — | |
| SCHEMBL21247206 | 0.57 | — | — | |
| SCHEMBL108518 | 0.57 | — | — | |
| SCHEMBL11697603 | 0.55 | — | — | |
| SCHEMBL4599771 | 0.55 | ALDH1A1 (0.41) | — | |
| SCHEMBL3503955 | 0.55 | ALDH1A1 (0.41) | — |
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-4048423-A | Process for polymerizing unsaturated monomers and unsaturated polyester resins employing unsymmetrical tertiary-aliphatic azoalkanes | PENNWALT CORPORATION (US) | 1977-09-13 | — | — | US | disclosed |
| US-4007165-A | VINYL POLYMERIZATION INITIATORS POLYESTER CURING AGENTS | PENNWALT CORPORATION (US) | 1977-02-08 | — | — | US | disclosed |