⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18032691 | 0.74 | GSK3A (0.30) | — | |
| SCHEMBL4419957 | 0.64 | — | — | |
| SCHEMBL181832 | 0.64 | USP2 (0.32) | — | |
| SCHEMBL4060921 | 0.62 | — | — | |
| SCHEMBL2858082 | 0.61 | — | — | |
| SCHEMBL869551 | 0.60 | — | — | |
| SCHEMBL7623581 | 0.59 | — | — | |
| SCHEMBL2405993 | 0.59 | — | — | |
| SCHEMBL19328568 | 0.58 | — | — | |
| Hydrochloric Acid SCHEMBL5089741 | 0.58 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0128116-A1 | Condensed N-phenylsulfonyl-N'-pyrimidinyl and triazinyl urea | CIBA-GEIGY AG (CH) | 1984-12-12 | — | — | EP | disclosed |