⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL600923 | 0.76 | DPP4 (0.34) | — | |
| SCHEMBL372402 | 0.72 | LMNA (0.32) | — | |
| SCHEMBL18355787 | 0.71 | — | — | |
| SCHEMBL606430 | 0.71 | — | — | |
| SCHEMBL20843821 | 0.71 | — | — | |
| SCHEMBL601379 | 0.71 | LMNA (0.33) | — | |
| SCHEMBL600539 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL31095712 | 0.70 | LMNA (0.31) | — | |
| SCHEMBL24837641 | 0.70 | — | — | |
| SCHEMBL604240 | 0.70 | JAK2 (0.31) | — |
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-2704568-B1 | DIAZENIUMDIOLATE CYCLOHEXYL DERIVATIVES | MERCK SHARP & DOHME (US) | 2018-01-24 | — | — | EP | disclosed |
| WO-2012111995-A1 | OXIME DERIVATIVES AS GPR119 AGONISTS | LG LIFE SCIENCES LTD. (KR) | 2012-08-23 | — | — | WO | disclosed |