⚠ 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 SCHEMBL17472549 | 0.98 | CYP3A4 (0.36) | — | |
| SCHEMBL12100121 | 0.85 | CYP3A4 (0.42) | — | |
| SCHEMBL31440759 | 0.83 | TSHR (0.45) | — | |
| SCHEMBL8521347 | 0.82 | TDP1 (0.36) | — | |
| SCHEMBL9929 | 0.81 | — | — | |
| SCHEMBL1407203 | 0.81 | TSHR (0.46) | — | |
| SCHEMBL8610698 | 0.81 | — | — | |
| SCHEMBL85962 | 0.81 | TSHR (0.52) | — | |
| SCHEMBL37401 | 0.79 | TSHR (0.50) | — | |
| SCHEMBL9636707 | 0.79 | TSHR (0.45) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050113594-A1 | Process using a cyclic carbonate reactant | SURFACE SPECIALTIES, S.A. (BE) | 2005-05-26 | — | — | US | claimed |
| EP-1474383-A1 | PROCESS USING A CYCLIC CARBONATE REACTANT | UCB, S.A. (BE) | 2004-11-10 | — | — | EP | claimed |
| WO-2003066580-A1 | PROCESS USING A CYCLIC CARBONATE REACTANT | UCB, S.A. (BE) | 2003-08-14 | — | — | WO | claimed |
| US-20050113594-A1 | Process using a cyclic carbonate reactant | SURFACE SPECIALTIES, S.A. (BE) | 2005-05-26 | — | — | US | disclosed |
| EP-1474383-A1 | PROCESS USING A CYCLIC CARBONATE REACTANT | UCB, S.A. (BE) | 2004-11-10 | — | — | EP | disclosed |
| WO-2003066580-A1 | PROCESS USING A CYCLIC CARBONATE REACTANT | UCB, S.A. (BE) | 2003-08-14 | — | — | WO | disclosed |