⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13225790 | 0.71 | — | — | |
| SCHEMBL9645938 | 0.68 | — | — | |
| SCHEMBL168654 | 0.64 | — | — | |
| SCHEMBL9645980 | 0.64 | — | — | |
| SCHEMBL12020267 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL4460764 | 0.64 | — | — | |
| SCHEMBL32676379 | 0.64 | — | — | |
| SCHEMBL5365847 | 0.64 | — | — | |
| SCHEMBL6403991 | 0.64 | — | — | |
| SCHEMBL6131421 | 0.64 | — | — |
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-4387257-A | BICYCLIC DIOLEFIN ANTIKNOCK ADDITIVE | PHILLIPS PETROLEUM COMPANY (US) | 1983-06-07 | — | — | US | disclosed |
| US-3963802-A | Blend of ethylene copolymer elastomer and a copolyetherester elastomer | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-06-15 | — | — | US | disclosed |