⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10390423 | 0.80 | ALDH1A1 (0.30) | — | |
| SCHEMBL6220047 | 0.75 | ELANE (0.30) | — | |
| SCHEMBL9531611 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL9532397 | 0.68 | NPSR1 (0.37) | — | |
| SCHEMBL9532323 | 0.68 | MAOB (0.36) | — | |
| SCHEMBL10389872 | 0.63 | CHRM2 (0.33) | — | |
| SCHEMBL9148372 | 0.62 | MAPT (0.37) | — | |
| SCHEMBL9531911 | 0.59 | — | — | |
| SCHEMBL2632864 | 0.59 | RARA (0.39) | — | |
| SCHEMBL8028203 | 0.59 | ALDH1A1 (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0314852-B1 | Process for the preparation of 1-substituted imidazole-carbonic acid and derivatives | CIBA GEIGY AG (CH) | 1993-11-18 | — | — | EP | disclosed |
| US-4921955-A | Process for the synthesis of 1-substituted imidazole-5-carboxylic acids and carboxylic acid derivatives | CIBA-GEIGY CORPORATION (US) | 1990-05-01 | — | — | US | disclosed |
| EP-0314852-A2 | Process for the preparation of 1-substituted imidazole-carbonic acid and derivatives | CIBA-GEIGY AG (CH) | 1989-05-10 | — | — | EP | disclosed |