⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7876056 | 0.91 | SCN1A (0.31) | — | |
| SCHEMBL11849600 | 0.84 | SIGMAR1 (0.33) | — | |
| SCHEMBL992288 | 0.84 | — | — | |
| SCHEMBL24494545 | 0.81 | — | — | |
| SCHEMBL6987243 | 0.78 | — | — | |
| SCHEMBL992562 | 0.77 | — | — | |
| Cyclohexylamine SCHEMBL953634 | 0.71 | ALDH1A1 (0.32) | — | |
| SCHEMBL17437762 | 0.69 | HSD11B1 (0.34) | — | |
| SCHEMBL8977694 | 0.67 | SIGMAR1 (0.31) | — | |
| SCHEMBL1987161 | 0.64 | NOS1 (0.39) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0697425-B1 | Hardener blend for epoxy resins | CIBA GEIGY AG (CH) | 1999-03-17 | — | — | EP | claimed |
| US-20230091804-A1 | COATING | JOTUN A/S (NO) | 2023-03-23 | — | — | US | disclosed |
| EP-4114903-A1 | COATING | Jotun A/S (NO) | 2023-01-11 | — | — | EP | disclosed |
| WO-2021175852-A1 | COATING | JOTUN A/S (NO) | 2021-09-10 | — | — | WO | disclosed |