⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1201321 | 0.76 | — | — | |
| SCHEMBL5050099 | 0.76 | — | — | |
| SCHEMBL131953 | 0.76 | — | — | |
| SCHEMBL4723350 | 0.74 | — | — | |
| SCHEMBL16289784 | 0.73 | — | — | |
| SCHEMBL1200558 | 0.69 | APP (0.46) | — | |
| SCHEMBL1979160 | 0.67 | CYP1A2 (0.41) | — | |
| SCHEMBL5908051 | 0.67 | — | — | |
| SCHEMBL751581 | 0.66 | HDAC8 (0.33) | — | |
| SCHEMBL195035 | 0.62 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20080234299-A1 | Quinazolinones | MERCK PATENT GMBH (DE) | 2008-09-25 | — | — | US | disclosed |
| EP-1885702-A2 | QUINAZOLINONES | Merck Patent GmbH (DE) | 2008-02-13 | — | — | EP | disclosed |
| WO-2006125555-A2 | QUINAZOLINONES | MERCK PATENT GMBH (DE) | 2006-11-30 | — | — | WO | disclosed |
| US-6034056-A | CYCLIC PEPTIDES; ANTIARTHRITIC AGENTS | ZENECA LIMITED (GB) | 2000-03-07 | — | — | US | disclosed |
| EP-0800535-A1 | FIBRONECTIN ADHESION INHIBITORS | ZENECA LIMITED (GB) | 1997-10-15 | — | — | EP | disclosed |
| US-5643878-A | TREATMENT OF RETROVIRAL DISEASES LIKE AIDS | CIBA-GEIGY CORPORATION (US) | 1997-07-01 | — | — | US | disclosed |
| WO-1996020216-A1 | FIBRONECTIN ADHESION INHIBITORS | ZENECA LIMITED (GB) | 1996-07-04 | — | — | WO | disclosed |
| EP-0618222-A2 | Dipeptid derivatives of 5-amino-4-hydroxy-hexanoic acid | CIBA-GEIGY AG (CH) | 1994-10-05 | — | — | EP | disclosed |