⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16605690 | 0.70 | LMNA (0.33) | — | |
| SCHEMBL18535426 | 0.61 | GALR3 (0.30) | — | |
| SCHEMBL12600966 | 0.60 | F2 (0.43) | — | |
| SCHEMBL18537454 | 0.59 | — | — | |
| SCHEMBL11827621 | 0.59 | — | — | |
| SCHEMBL3746961 | 0.58 | — | — | |
| SCHEMBL8952866 | 0.56 | — | — | |
| SCHEMBL6693515 | 0.56 | — | — | |
| SCHEMBL5075454 | 0.54 | — | — | |
| SCHEMBL10959053 | 0.54 | — | — |
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-5216173-A | Curing agents for epoxy resins; polyimides | HENKEL RESEARCH CORPORATION (US) | 1993-06-01 | — | — | US | disclosed |
| WO-1991001307-A2 | N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF | HENKEL RESEARCH CORPORATION (US) | 1991-02-07 | — | — | WO | disclosed |