⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2803686 | 0.80 | — | — | |
| SCHEMBL3946295 | 0.76 | — | — | |
| SCHEMBL9844598 | 0.74 | — | — | |
| SCHEMBL5737555 | 0.69 | CA1 (0.47) | — | |
| SCHEMBL1939208 | 0.67 | — | — | |
| SCHEMBL9735239 | 0.67 | — | — | |
| SCHEMBL4986331 | 0.65 | — | — | |
| SCHEMBL3948153 | 0.65 | — | — | |
| Lactic Acid SCHEMBL11197774 | 0.65 | TP53 (0.58) | — | |
| SCHEMBL97684 | 0.63 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0365541-B1 | PREPARATION OF 5-ACYLAMINO-2,4,6-TRIIODO- OR TRIBROMO-BENZOIC ACID DERIVATIVES | BRACCO S.p.A. (IT) | 1992-08-12 | — | — | EP | disclosed |
| US-5066823-A | Rearrangement reaction, contrast agent for radiology | BRACCO INDUSTRIA CHEMICA S.P.A. (IT) | 1991-11-19 | — | — | US | disclosed |