⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19406986 | 0.70 | — | — | |
| SCHEMBL3149317 | 0.67 | — | — | |
| SCHEMBL3149312 | 0.67 | — | — | |
| SCHEMBL9179585 | 0.62 | — | — | |
| SCHEMBL322272 | 0.62 | — | — | |
| SCHEMBL36406 | 0.61 | — | — | |
| SCHEMBL12172192 | 0.60 | — | — | |
| SCHEMBL27342385 | 0.60 | — | — | |
| SCHEMBL28371140 | 0.60 | — | — | |
| SCHEMBL5608560 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0826729-A1 | Universal EPDM/BUTYL compound for use as an elastomeric barrier in water storage and treatment systems | Amtrol Inc. (US) | 1998-03-04 | — | — | EP | disclosed |
| US-5691406-A | DIENE-ETHYLENE-PROPYLENE TERPOLYMER, HALOGENATED ISOBUTYLENE, CARBON BLACK, PARAFFIN OIL, ORGANOFUNCTIONAL MAGNESIUM SILICATE, MAGNESIUM OXIDE, ZINC OXIDE, STEARIC ACID AND VULCANIZATION AGENT | AMTROL INC. (US) | 1997-11-25 | — | — | US | disclosed |