⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11233882 | 0.79 | TP53 (0.33) | — | |
| SCHEMBL11222231 | 0.77 | — | — | |
| SCHEMBL11222730 | 0.76 | TP53 (0.39) | — | |
| SCHEMBL11225397 | 0.74 | — | — | |
| SCHEMBL11828007 | 0.74 | — | — | |
| SCHEMBL11581549 | 0.74 | — | — | |
| SCHEMBL11227092 | 0.74 | TP53 (0.47) | — | |
| SCHEMBL11223611 | 0.73 | — | — | |
| SCHEMBL11217817 | 0.73 | — | — | |
| SCHEMBL11221941 | 0.73 | TP53 (0.46) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-104080766-A | Sulphamide derivative having an adamantyl group and a pharmaceutically acceptable salt thereof | KOREA RES INST CHEM TECH | 2014-10-01 | — | — | CN | disclosed |
| US-4327034-A | CHEMICAL INTERMEDIATE PREPARED FROM A SULFAMIC ACID HALIDE AND A HALOGEN COMPOUND | BASF AKTIENGESELLSCHAFT (DE) | 1982-04-27 | — | — | US | disclosed |