⚠ 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 | |
|---|---|---|---|---|
| Ethylene Glycol SCHEMBL19521040 | 0.86 | TSHR (0.42) | — | |
| SCHEMBL23732 | 0.85 | — | — | |
| SCHEMBL8852489 | 0.85 | TSHR (0.54) | — | |
| SCHEMBL20807 | 0.84 | — | — | |
| Propene SCHEMBL7585110 | 0.81 | TSHR (0.67) | — | |
| Propene SCHEMBL935568 | 0.81 | — | — | |
| Propene SCHEMBL9244873 | 0.81 | TSHR (0.67) | — | |
| SCHEMBL23116592 | 0.80 | — | — | |
| Phosphine SCHEMBL20503111 | 0.80 | — | — | |
| SCHEMBL8523341 | 0.80 | — | — |
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-1242483-A1 | PROPYLENE DIENE COPOLYMERIZED POLYMERS | EXXON CHEMICAL PATENTS INC. (US) | 2002-09-25 | — | — | EP | disclosed |
| WO-2001042322-A1 | PROPYLENE DIENE COPOLYMERIZED POLYMERS | EXXON CHEMICAL PATENTS INC. (US) | 2001-06-14 | — | — | WO | disclosed |