⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16203406 | 1.00 | — | — | |
| SCHEMBL172671 | 0.82 | ALDH1A1 (0.37) | — | |
| SCHEMBL708860 | 0.78 | — | — | |
| SCHEMBL21372972 | 0.76 | — | — | |
| SCHEMBL172387 | 0.74 | — | — | |
| SCHEMBL172424 | 0.74 | — | — | |
| SCHEMBL10291757 | 0.74 | — | — | |
| SCHEMBL4112036 | 0.72 | — | — | |
| SCHEMBL22546452 | 0.72 | — | — | |
| SCHEMBL3072086 | 0.72 | — | — |
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-0378910-B1 | Method for the preparation of imidazoles | TEXACO DEVELOPMENT CORP (US) | 1994-08-31 | — | — | EP | disclosed |
| EP-0378910-A1 | Method for the preparation of imidazoles | TEXACO DEVELOPMENT CORPORATION (US) | 1990-07-25 | — | — | EP | disclosed |
| US-4921969-A | Method for the preparation of imidazoles | TEXACO CHEMICAL CO. (US) | 1990-05-01 | — | — | US | disclosed |
| EP-0022209-A2 | Fluor-triazine dyestuffs and their use in dyeing cellulosic fibrous materials | BAYER AG (DE) | 1981-01-14 | — | — | EP | disclosed |