⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11237349 | 0.79 | — | — | |
| SCHEMBL11222072 | 0.67 | — | — | |
| SCHEMBL9630685 | 0.67 | ALOX5AP (0.32) | — | |
| SCHEMBL31664570 | 0.65 | CA1 (0.32) | — | |
| SCHEMBL11226214 | 0.65 | — | — | |
| SCHEMBL11222167 | 0.65 | — | — | |
| SCHEMBL10480499 | 0.65 | ALOX5AP (0.31) | — | |
| SCHEMBL10480538 | 0.65 | ALOX5AP (0.31) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL7006307 | 0.64 | ALDH1A1 (0.39) | — | |
| SCHEMBL11394301 | 0.64 | CA14 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4327034-A | CHEMICAL INTERMEDIATE PREPARED FROM A SULFAMIC ACID HALIDE AND A HALOGEN COMPOUND | BASF AKTIENGESELLSCHAFT (DE) | 1982-04-27 | — | — | US | disclosed |