⚠ 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 | |
|---|---|---|---|---|
| Carbon Monoxide SCHEMBL10766248 | 1.00 | TSHR (0.31) | — | |
| Carbon Monoxide SCHEMBL2842408 | 1.00 | TSHR (0.31) | — | |
| SCHEMBL3958724 | 0.87 | — | — | |
| SCHEMBL16671468 | 0.78 | — | — | |
| SCHEMBL11691 | 0.67 | — | — | |
| Allyl Alcohol SCHEMBL7495069 | 0.67 | — | — | |
| Carbon Monoxide SCHEMBL934412 | 0.67 | — | — | |
| Carbon Monoxide SCHEMBL544386 | 0.67 | TSHR (0.31) | — | |
| Carbon Monoxide SCHEMBL9016270 | 0.67 | — | — | |
| Carbon Monoxide SCHEMBL6131565 | 0.67 | TSHR (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100249321-A1 | Polymerisation of ethylenically unsaturated monomers | CRODA INTERNATIONAL PLC (GB) | 2010-09-30 | — | — | US | disclosed |
| US-7759443-B2 | Polymerisation of ethylenically unsaturated monomers | Croda International, Inc. (GB) | 2010-07-20 | — | — | US | disclosed |
| US-20070037938-A1 | Using a catalyst system including: a manganese carbonyl radical initiator (dimanganese decacarbonyl); a halogen containing reactive substrate; and an allylic halogen substituted chain termination agent (2,3-dibromopropene) to produce telechelic polymers with narrow molecular weight distribution | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 2007-02-15 | — | — | US | disclosed |
| EP-1606323-A1 | POLYMERISATION OF ETHYLENICALLY UNSATURATED MONOMERS | Imperial Chemical Industries PLC (GB) | 2005-12-21 | — | — | EP | disclosed |
| WO-2004085494-A1 | POLYMERISATION OF ETHYLENICALLY UNSATURATED MONOMERS | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 2004-10-07 | — | — | WO | disclosed |