⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3915599 | 0.97 | — | — | |
| SCHEMBL31439002 | 0.76 | CTSL (0.35) | — | |
| SCHEMBL3546430 | 0.75 | CA2 (0.33) | — | |
| SCHEMBL3549294 | 0.75 | CA2 (0.33) | — | |
| SCHEMBL3547679 | 0.75 | CA2 (0.33) | — | |
| SCHEMBL3546043 | 0.75 | CA2 (0.33) | — | |
| SCHEMBL2323466 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL31439064 | 0.75 | CTSL (0.33) | — | |
| SCHEMBL16612338 | 0.72 | — | — | |
| SCHEMBL6005300 | 0.63 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114555053-A | Methods of treating breast cancer | 欧拉泰克治疗有限责任公司 | 2022-05-27 | — | — | CN | disclosed |
| CN-111867678-A | Method for treating melanoma | 欧拉泰克治疗有限责任公司 | 2020-10-30 | — | — | CN | disclosed |
| CN-111670032-A | Methods for preventing or treating alzheimer's disease | 欧拉泰克治疗有限责任公司 | 2020-09-15 | — | — | CN | disclosed |
| EP-1858509-A4 | NOVEL CATHEPSIN C INHIBITORS AND THEIR USE | GLAXO GROUP LTD (GB) | 2009-03-18 | — | — | EP | disclosed |
| EP-1858509-A1 | NOVEL CATHEPSIN C INHIBITORS AND THEIR USE | GLAXO GROUP LIMITED (GB) | 2007-11-28 | — | — | EP | disclosed |
| WO-2006094003-A1 | NOVEL CATHEPSIN C INHIBITORS AND THEIR USE | GLAXO GROUP LIMITED (GB) | 2006-09-08 | — | — | WO | disclosed |