⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12300807 | 0.89 | MC4R (0.38) | — | |
| SCHEMBL27133921 | 0.88 | — | — | |
| SCHEMBL26187272 | 0.88 | — | — | |
| SCHEMBL4089166 | 0.86 | FDPS (0.31) | — | |
| SCHEMBL19362383 | 0.82 | SLC6A2 (0.34) | — | |
| SCHEMBL4090482 | 0.78 | GNAI3 (0.37) | — | |
| SCHEMBL12300812 | 0.69 | MC4R (0.36) | — | |
| SCHEMBL3346527 | 0.67 | — | — | |
| SCHEMBL9695357 | 0.67 | — | — | |
| SCHEMBL11570613 | 0.67 | — | — |
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-4173580-A | Production of β-haloalkylaminosulfonyl halides | BASF AKTIENGESELLSCHAFT (DE) | 1979-11-06 | — | — | US | disclosed |
| US-4014931-A | FROM AZIRIDINE AND SULFURYL HALIDE | BASF AKTIENGESELLSCHAFT (DT) | 1977-03-29 | — | — | US | disclosed |