⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6136840 | 1.00 | — | — | |
| Trifluoroacetic Acid SCHEMBL6704433 | 0.87 | KDM4E (0.30) | — | |
| SCHEMBL6705040 | 0.83 | FAAH (0.33) | — | |
| SCHEMBL4773141 | 0.77 | FFAR1 (0.36) | — | |
| Hydrochloric Acid SCHEMBL3526047 | 0.76 | FFAR1 (0.35) | — | |
| Trifluoroacetic Acid SCHEMBL6792658 | 0.74 | KDM4E (0.31) | — | |
| Vuf-5296 SCHEMBL6136537 | 0.74 | — | — | |
| Vuf-5296 SCHEMBL8846403 | 0.74 | — | — | |
| Vuf-5296 SCHEMBL7784076 | 0.74 | — | — | |
| Vuf-5296 SCHEMBL8846552 | 0.74 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6794405-B2 | Alicyclic imidazoles as H3 agents | MERCK & CO., INC. | 2004-09-21 | — | — | US | claimed |
| US-20040029943-A1 | Novel alicylic imidazoles as H3 agents | MERCK SHARP & DOHME CORP. | 2004-02-12 | — | — | US | claimed |
| US-20020042400-A1 | Novel alicyclic imidazoles as H3 agents | GLIATECH, INC. | 2002-04-11 | — | — | US | claimed |
| EP-1313470-A4 | NOVEL ALICYCLIC IMIDAZOLES AS H 3 AGENTS | GLIATECH INC (US) | 2005-02-16 | — | — | EP | disclosed |
| US-6794405-B2 | Alicyclic imidazoles as H3 agents | MERCK & CO., INC. | 2004-09-21 | — | — | US | disclosed |
| US-20040029943-A1 | Novel alicylic imidazoles as H3 agents | MERCK SHARP & DOHME CORP. | 2004-02-12 | — | — | US | disclosed |
| EP-1313470-A1 | NOVEL ALICYCLIC IMIDAZOLES AS H 3 AGENTS | GLIATECH, INC. (US) | 2003-05-28 | — | — | EP | disclosed |
| US-20020042400-A1 | Novel alicyclic imidazoles as H3 agents | GLIATECH, INC. | 2002-04-11 | — | — | US | disclosed |
| WO-2002013821-A1 | NOVEL ALICYCLIC IMIDAZOLES AS H3 AGENTS | GLIATECH, INC. (US) | 2002-02-21 | — | — | WO | disclosed |