⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3626679 | 0.78 | — | — | |
| SCHEMBL27807528 | 0.76 | — | — | |
| SCHEMBL6278856 | 0.76 | — | — | |
| SCHEMBL31588943 | 0.76 | CYP3A4 (0.33) | — | |
| SCHEMBL29642086 | 0.75 | — | — | |
| SCHEMBL28785830 | 0.75 | — | — | |
| SCHEMBL27713922 | 0.73 | — | — | |
| SCHEMBL28564544 | 0.73 | — | — | |
| SCHEMBL4308432 | 0.72 | — | — | |
| SCHEMBL31124103 | 0.72 | KDM4E (0.30) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0379300-A2 | Separation of 1,2-dihydroxycyclohexa-3,5-diene compounds | ZENECA LIMITED (GB) | 1990-07-25 | — | — | EP | claimed |
| US-7456298-B2 | Synthesis of acetonides from aryl silanes | GENENCOR INTERNATIONAL, INC. (US) | 2008-11-25 | — | — | US | disclosed |
| US-7381830-B2 | Synthesis of cis-diols from aryl silanes | GENENCOR INTERNATIONAL, INC. (US) | 2008-06-03 | — | — | US | disclosed |
| US-20070213541-A1 | Synthesis of acetonides from aryl silanes | DOW CORNING CORPORATION | 2007-09-13 | — | — | US | disclosed |
| US-20070213550-A1 | Synthesis of cis-diols from aryl silanes | DOW CORNING CORPORATION | 2007-09-13 | — | — | US | disclosed |
| WO-1995013284-A1 | ASYMMETRIC HYDROBORATION | ISIS INNOVATION LIMITED (GB) | 1995-05-18 | — | — | WO | disclosed |
| EP-0250122-A2 | Production of cells | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1987-12-23 | — | — | EP | disclosed |