⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4792964 | 0.71 | APLNR (0.31) | — | |
| SCHEMBL5972461 | 0.70 | — | — | |
| SCHEMBL301106 | 0.60 | — | — | |
| SCHEMBL4203063 | 0.60 | — | — | |
| SCHEMBL23970044 | 0.56 | — | — | |
| SCHEMBL14325674 | 0.56 | — | — | |
| SCHEMBL1316560 | 0.55 | ESR2 (0.46) | — | |
| SCHEMBL10355207 | 0.55 | — | — | |
| SCHEMBL1703765 | 0.55 | PLG (0.55) | — | |
| SCHEMBL2150283 | 0.55 | ALDH1A1 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2094759-A1 | EPOXY RESINS COMPRISING A CYCLOALPHATIC DIAMINE CURING AGENT | Dow Global Technologies Inc. (US) | 2009-09-02 | — | — | EP | disclosed |
| WO-2008064115-A1 | EPOXY RESINS COMPRISING A CYCLOALIPHATIC DIAMINE CURING AGENT | DOW GLOBAL TECHNOLOGIES INC. (US) | 2008-05-29 | — | — | WO | disclosed |