⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9752272 | 0.77 | POLB (0.39) | — | |
| SCHEMBL9550312 | 0.77 | — | — | |
| SCHEMBL9550324 | 0.71 | — | — | |
| SCHEMBL9631621 | 0.69 | GRM4 (0.45) | — | |
| SCHEMBL100367 | 0.68 | — | — | |
| SCHEMBL9752292 | 0.67 | GRM4 (0.49) | — | |
| SCHEMBL9752290 | 0.67 | GRM4 (0.49) | — | |
| SCHEMBL17476091 | 0.66 | — | — | |
| SCHEMBL3262651 | 0.65 | — | — | |
| SCHEMBL11214566 | 0.63 | MCL1 (0.30) | — |
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 3 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 |
| EP-0484381-A1 | N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF | HENKEL RESEARCH CORPORATION (US) | 1992-05-13 | — | — | EP | disclosed |
| WO-1991001307-A2 | N-CYANOIMIDES AND PROCESS FOR THEIR PREPARATION AND USES THEREOF | HENKEL RESEARCH CORPORATION (US) | 1991-02-07 | — | — | WO | disclosed |