⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12825053 | 1.00 | — | — | |
| SCHEMBL381734 | 1.00 | — | — | |
| SCHEMBL9101436 | 0.89 | — | — | |
| SCHEMBL127505 | 0.83 | SLC6A2 (0.31) | — | |
| SCHEMBL1044479 | 0.82 | — | — | |
| SCHEMBL8235057 | 0.82 | — | — | |
| SCHEMBL555028 | 0.82 | — | — | |
| Tetrahydrofuran SCHEMBL28754477 | 0.82 | ALDH1A1 (0.33) | — | |
| SCHEMBL4537329 | 0.80 | — | — | |
| SCHEMBL2948865 | 0.80 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024049543-A1 | COMPOSITIONS AND METHODS FOR TRANSGLUTAMINASE-MEDIATED ENDOCYTOSIS | THE BOARD OF TRUSTEES OF THE LELAND STANFORD JUNIOR UNIVERSITY (US) | 2024-03-07 | — | — | WO | disclosed |
| US-20230295259-A1 | Conjugated Hepcidin Mimetics | PROTAGONIST THERAPEUTICS, INC. | 2023-09-21 | — | — | US | disclosed |
| CN-116457000-A | Conjugated hepcidin mimetics | 普罗塔格尼斯特治疗股份有限公司 | 2023-07-18 | — | — | CN | disclosed |
| EP-4188412-A1 | CONJUGATED HEPCIDIN MIMETICS | Protagonist Therapeutics, Inc. (US) | 2023-06-07 | — | — | EP | disclosed |
| WO-2022026631-A1 | CONJUGATED HEPCIDIN MIMETICS | PROTAGONIST THERAPEUTICS, INC. (US) | 2022-02-03 | — | — | WO | disclosed |
| US-7361494-B1 | Tetrahydropyrimidine dioxygenase gene, polypeptides encoded by said gene and method for producing the same | MERCK PATENT GMBH (DE) | 2008-04-22 | — | — | US | disclosed |