⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25761255 | 1.00 | — | — | |
| SCHEMBL22161350 | 0.79 | — | — | |
| SCHEMBL13283251 | 0.77 | ADH1B (0.68) | — | |
| SCHEMBL26236 | 0.77 | — | — | |
| SCHEMBL28150968 | 0.75 | — | — | |
| SCHEMBL17275391 | 0.75 | — | — | |
| SCHEMBL19390046 | 0.74 | — | — | |
| SCHEMBL3936013 | 0.74 | — | — | |
| SCHEMBL5251290 | 0.74 | — | — | |
| SCHEMBL16016254 | 0.73 | ADH1B (0.43) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0562345-B1 | Process for the preparation of 4-substituted imidazoles | BASF AG (DE) | 1998-05-20 | — | — | EP | disclosed |
| US-5359082-A | Preparation of 4-substituted imidazoles from N-formyl-α-aminonitrile | BASF AKTIENGESELLSCHAFT (DE) | 1994-10-25 | — | — | US | disclosed |
| EP-0612797-A2 | Modification method of resins | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1994-08-31 | — | — | EP | disclosed |
| EP-0562345-A2 | Process for the preparation of 4-substituted imidazoles | BASF Aktiengesellschaft (DE) | 1993-09-29 | — | — | EP | disclosed |