⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4105289 | 1.00 | — | — | |
| SCHEMBL6589810 | 0.80 | — | — | |
| SCHEMBL6589804 | 0.80 | — | — | |
| SCHEMBL24588509 | 0.74 | — | — | |
| SCHEMBL8224498 | 0.74 | — | — | |
| SCHEMBL14423275 | 0.74 | — | — | |
| SCHEMBL8224493 | 0.74 | — | — | |
| SCHEMBL8225998 | 0.72 | GRIK1 (0.32) | — | |
| SCHEMBL8226004 | 0.72 | GRIK1 (0.32) | — | |
| SCHEMBL11045676 | 0.72 | TSHR (0.32) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20090076136-A1 | THERAPEUTIC AGENT | ENOKI TATSUJI | 2009-03-19 | — | — | US | disclosed |
| CN-101310716-A | Therapeutic agent | TAKARA BIO INC (JP) | 2008-11-26 | — | — | CN | disclosed |
| CN-100415218-C | Therapeutic agents | TAKARA BIO INC (JP) | 2008-09-03 | — | — | CN | disclosed |
| US-20070060641-A1 | Therapeutic agent | TAKARA BIO INC. (JP) | 2007-03-15 | — | — | US | disclosed |
| CN-1791392-A | Therapeutic agents | TAKARA BIO INC (JP) | 2006-06-21 | — | — | CN | disclosed |
| EP-1627632-A1 | THERAPEUTIC AGENT | TAKARA BIO INC. (JP) | 2006-02-22 | — | — | EP | disclosed |