⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8732335 | 0.77 | — | — | |
| SCHEMBL27558609 | 0.74 | DPP4 (0.42) | — | |
| SCHEMBL7355072 | 0.74 | KCNA5 (0.33) | — | |
| SCHEMBL28252200 | 0.72 | — | — | |
| SCHEMBL1363734 | 0.72 | — | — | |
| SCHEMBL39895 | 0.72 | — | — | |
| SCHEMBL16346426 | 0.72 | — | — | |
| SCHEMBL6123340 | 0.72 | ANPEP (0.34) | — | |
| SCHEMBL175469 | 0.72 | ANPEP (0.31) | — | |
| SCHEMBL8628026 | 0.71 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-102802622-B | For treating composition and the method for ischemic and ischemical reperfusion injury | 艾雪米克斯公司 | 2017-03-15 | — | — | CN | disclosed |
| US-7390847-B2 | Polymer derivatives for the treatment of metals | BASF SE (DE) | 2008-06-24 | — | — | US | disclosed |
| US-20050121114-A1 | Polymer derivatives for the treatment of metals | BASF AKTIENGESELLSCHAFT (DE) | 2005-06-09 | — | — | US | disclosed |
| CN-1620485-A | Polymer derivatives for the treatment of metals | BASF AG (DE) | 2005-05-25 | — | — | CN | disclosed |
| CN-1230884-A | Thiol sulfone metalloprotease inhibitors | MONSANTO CO (US) | 1999-10-06 | — | — | CN | disclosed |