⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1712880 | 0.78 | — | — | |
| SCHEMBL16677169 | 0.76 | — | — | |
| SCHEMBL16670028 | 0.70 | HCAR2 (0.31) | — | |
| SCHEMBL11395524 | 0.70 | ALDH1A1 (0.41) | — | |
| SCHEMBL15900252 | 0.69 | NPSR1 (0.38) | — | |
| SCHEMBL16669824 | 0.64 | HCAR2 (0.37) | — | |
| SCHEMBL9617684 | 0.62 | — | — | |
| SCHEMBL2629384 | 0.62 | — | — | |
| SCHEMBL3932688 | 0.61 | HTT (0.31) | — | |
| SCHEMBL7850001 | 0.61 | HDAC8 (0.34) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9439910-B2 | Fe(III)-pyrazine complex compounds for treatment and prophylaxis of iron-deficiency phenomena and iron-deficiency anaemia | VIFOR (INTERNATIONAL) AG (CH) | 2016-09-13 | — | — | US | disclosed |
| US-9439910-B2 | Fe(III)-pyrazine complex compounds for treatment and prophylaxis of iron-deficiency phenomena and iron-deficiency anaemia | VIFOR (INTERNATIONAL) AG (CH) | 2016-09-13 | — | — | US | disclosed |
| US-20150119374-A1 | FE(III)-PYRAZINE COMPLEX COMPOUNDS FOR TREATMENT AND PROPHYLAXIS OF IRON-DEFICIENCY PHENOMENA AND IRON-DEFICIENCY ANAEMIA | VIFOR INT AG (CH) | 2015-04-30 | — | — | US | disclosed |
| US-20150119374-A1 | FE(III)-PYRAZINE COMPLEX COMPOUNDS FOR TREATMENT AND PROPHYLAXIS OF IRON-DEFICIENCY PHENOMENA AND IRON-DEFICIENCY ANAEMIA | VIFOR INT AG (CH) | 2015-04-30 | — | — | US | disclosed |