⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL363537 | 0.67 | — | — | |
| Ethylene SCHEMBL11166078 | 0.60 | — | — | |
| SCHEMBL6744529 | 0.56 | — | — | |
| SCHEMBL6369223 | 0.56 | — | — | |
| SCHEMBL1612 | 0.54 | — | — | |
| SCHEMBL121126 | 0.54 | — | — | |
| SCHEMBL20681204 | 0.54 | — | — | |
| Ethylene SCHEMBL9807200 | 0.53 | — | — | |
| SCHEMBL5586217 | 0.53 | — | — | |
| Iodide SCHEMBL2788357 | 0.50 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6774212-B2 | FOR THERAPY OF VIRAL INFECTION OR AS AN ASSAY STANDARD OR REAGENT | BRISTOL-MYERS SQUIBB PHARMA COMPANY | 2004-08-10 | — | — | US | disclosed |
| US-4057418-A | Sulfonylmethylamino-substituted benzoic acids and herbicidal method therewith | BAYER AKTIENGESELLSCHAFT (DT) | 1977-11-08 | — | — | US | disclosed |