⚠ 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 | |
|---|---|---|---|---|
| Benzene SCHEMBL28249177 | 0.89 | ALDH1A1 (0.35) | — | |
| Acetonitrile SCHEMBL28641913 | 0.85 | — | — | |
| SCHEMBL27341682 | 0.78 | — | — | |
| Sulfuric Acid SCHEMBL27888295 | 0.75 | CA5A (0.50) | — | |
| Sulfuric Acid SCHEMBL4170715 | 0.75 | — | — | |
| Sulfuric Acid SCHEMBL27871725 | 0.75 | CA5A (0.50) | — | |
| SCHEMBL27501474 | 0.75 | — | — | |
| Sulfuric Acid SCHEMBL7533455 | 0.75 | CA5A (0.50) | — | |
| Sulfuric Acid SCHEMBL1199700 | 0.75 | — | — | |
| Sulfuric Acid SCHEMBL11400477 | 0.72 | CA5A (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110483335-A | Amyloid protein targeting agent and its application method | AMYDIS INC | 2019-11-22 | — | — | CN | disclosed |
| CN-106573880-B | Amyloid targeting agents and methods of use thereof | 阿米达斯公司 | 2019-07-30 | — | — | CN | disclosed |
| 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 |