⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6292229 | 0.83 | ALDH1A1 (0.34) | — | |
| SCHEMBL28887753 | 0.74 | KDM4E (0.41) | — | |
| SCHEMBL28820704 | 0.73 | — | — | |
| SCHEMBL7087320 | 0.73 | — | — | |
| SCHEMBL974768 | 0.73 | — | — | |
| SCHEMBL18770037 | 0.72 | CES2 (0.38) | — | |
| SCHEMBL13049960 | 0.72 | KDM4E (0.45) | — | |
| SCHEMBL1414863 | 0.72 | KDM4E (0.45) | — | |
| SCHEMBL627336 | 0.71 | ALDH1A1 (0.33) | — | |
| SCHEMBL13873989 | 0.70 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1654298-B1 | PROCESS OF PREPARING REGIOREGULAR POLYMERS | MERCK PATENT GMBH (DE) | 2008-10-01 | — | — | EP | disclosed |
| US-20080164465-A1 | Electronic Device | KONINKLIJKE PHILIPS ELECTRONICS, N.V. (NL) | 2008-07-10 | — | — | US | disclosed |
| EP-1854159-A1 | ELECTRONIC DEVICE | Koninklijke Philips Electronics N.V. (NL) | 2007-11-14 | — | — | EP | disclosed |
| US-7294288-B2 | Process of preparing regioregular polymers | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 2007-11-13 | — | — | US | disclosed |
| WO-2006087680-A1 | ELECTRONIC DEVICE | KONINKLIJKE PHILIPS ELECTRONICS N.V. (NL) | 2006-08-24 | — | — | WO | disclosed |
| EP-1654298-A2 | PROCESS OF PREPARING REGIOREGULAR POLYMERS | MERCK PATENT GmbH (DE) | 2006-05-10 | — | — | EP | disclosed |
| US-20050080219-A1 | Process of preparing regioregular polymers | MERCK PATENT GMBH (DE) | 2005-04-14 | — | — | US | disclosed |
| WO-2005014691-A2 | PROCESS OF PREPARING REGIOREGULAR POLYMERS | MERCK PATENT GMBH (DE) | 2005-02-17 | — | — | WO | disclosed |
| EP-0410379-B1 | Pharmaceutically active 3-aryl and 3-heteroaryl-2-fluoro-1-olefins | MERRELL DOW PHARMA (US) | 1996-01-31 | — | — | EP | disclosed |
| US-5068465-A | Hypotensive agents or enzyme inhibitors for treatment of hypertension | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-11-26 | — | — | US | disclosed |
| EP-0410379-A2 | Pharmaceutically active 3-aryl and 3-heteroaryl-2-fluoro-1-olefins | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-01-30 | — | — | EP | disclosed |
| US-4981868-A | ENZYME INHIBITORS, HYPOTENSIVES | MERRELL DOW PHARMACEUTICAL (US) | 1991-01-01 | — | — | US | disclosed |