⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11516095 | 1.00 | — | — | |
| SCHEMBL18005840 | 0.79 | — | — | |
| SCHEMBL442524 | 0.77 | — | — | |
| SCHEMBL442525 | 0.77 | — | — | |
| SCHEMBL17230756 | 0.77 | — | — | |
| SCHEMBL28030352 | 0.74 | — | — | |
| SCHEMBL5963295 | 0.72 | — | — | |
| SCHEMBL10954775 | 0.72 | — | — | |
| SCHEMBL5963298 | 0.72 | — | — | |
| SCHEMBL18760857 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4168244-A | CONJUGATED DIOLEFINS TO HIGH MOLECULAR WEIGHT STEREOREGULAR POLYMERS | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1979-09-18 | — | — | US | claimed |
| US-4048418-A | Method of polymerization of conjugated diolefins using iron catalysts and nitrogen ligands | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1977-09-13 | — | — | US | claimed |
| US-4168244-A | CONJUGATED DIOLEFINS TO HIGH MOLECULAR WEIGHT STEREOREGULAR POLYMERS | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1979-09-18 | — | — | US | disclosed |
| US-4048418-A | Method of polymerization of conjugated diolefins using iron catalysts and nitrogen ligands | THE GOODYEAR TIRE & RUBBER COMPANY (US) | 1977-09-13 | — | — | US | disclosed |