⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8770001 | 0.76 | — | — | |
| SCHEMBL1985501 | 0.69 | — | — | |
| SCHEMBL1028327 | 0.69 | — | — | |
| SCHEMBL228107 | 0.66 | — | — | |
| SCHEMBL8581254 | 0.65 | — | — | |
| SCHEMBL7904248 | 0.65 | — | — | |
| SCHEMBL43047 | 0.64 | — | — | |
| SCHEMBL16656 | 0.64 | — | — | |
| SCHEMBL8769406 | 0.62 | — | — | |
| SCHEMBL7113434 | 0.62 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20140349989-A1 | COMPOUNDS AND THERAPEUTIC USES THEREOF | ALZHEIMER'S INSTITUTE OF AMERICA (US) | 2014-11-27 | — | — | US | disclosed |
| EP-2739144-A1 | COMPOUNDS AND THERAPEUTIC USES THEREOF | Alzheimer's Institute of America, Inc. (US) | 2014-06-11 | — | — | EP | disclosed |
| WO-2012177782-A1 | COMPOUNDS AND THERAPEUTIC USES THEREOF | MYREXIS, INC. (US) | 2012-12-27 | — | — | WO | disclosed |
| WO-1992006951-A1 | DIACETYLENE ETHERS | ISP INVESTMENTS INC. (US) | 1992-04-30 | — | — | WO | disclosed |