⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15606020 | 0.75 | BACE1 (0.41) | — | |
| SCHEMBL15606165 | 0.56 | BACE1 (0.38) | — | |
| SCHEMBL15606000 | 0.54 | SIGMAR1 (0.30) | — | |
| SCHEMBL7519149 | 0.52 | USP2 (0.36) | — | |
| SCHEMBL15606152 | 0.52 | BACE1 (0.37) | — | |
| SCHEMBL11668479 | 0.51 | SIGMAR1 (0.43) | — | |
| SCHEMBL8023504 | 0.50 | SIGMAR1 (0.39) | — | |
| SCHEMBL24129611 | 0.50 | MEN1 (0.32) | — | |
| SCHEMBL11490466 | 0.50 | MEN1 (0.34) | — | |
| SCHEMBL14430484 | 0.50 | L3MBTL1 (0.45) | — |
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-9233982-B2 | Spiro tetrahydro—benzothiophen derivatives useful for the treatment neurodegenerative diseases | ARES TRADING S.A. (CH) | 2016-01-12 | — | — | US | disclosed |
| US-20150111882-A1 | SPIRO TETRAHYDRO - BENZOTHIOPHEN DERIVATIVES USEFUL FOR THE TREATMENT NEURODEGENERATIVE DISEASES | ARES TRADING S.A. (CH) | 2015-04-23 | — | — | US | disclosed |