⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL234679 | 0.61 | — | — | |
| SCHEMBL15660831 | 0.61 | — | — | |
| SCHEMBL2157236 | 0.56 | — | — | |
| SCHEMBL2872531 | 0.56 | — | — | |
| SCHEMBL1135991 | 0.56 | — | — | |
| Butadiene SCHEMBL11078743 | 0.56 | — | — | |
| SCHEMBL11125371 | 0.53 | — | — | |
| SCHEMBL499542 | 0.53 | — | — | |
| SCHEMBL6964638 | 0.53 | — | — | |
| SCHEMBL5576463 | 0.53 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0729341-B1 | HYDROPHILIZED DENTAL IMPRESSION COMPOUNDS | ESPE DENTAL AG (DE) | 2000-04-05 | — | — | EP | disclosed |
| EP-0729341-A1 | HYDROPHILIZED DENTAL IMPRESSION COMPOUNDS | THERA Patent GmbH & Co. KG Gesellschaft für industrielle Schutzrechte (DE) | 1996-09-04 | — | — | EP | disclosed |
| WO-1996008230-A1 | HYDROPHILIZED DENTAL IMPRESSION COMPOUNDS | THERA PATENT GMBH & CO. KG GESELLSCHAFT FÜR INDUSTRIELLE SCHUTZRECHTE (DE) | 1996-03-21 | — | — | WO | disclosed |