⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7657432 | 0.89 | BRS3 (0.34) | — | |
| SCHEMBL7657698 | 0.89 | GSK3B (0.32) | — | |
| SCHEMBL7653995 | 0.87 | BRS3 (0.31) | — | |
| SCHEMBL7652985 | 0.87 | — | — | |
| SCHEMBL7924096 | 0.85 | — | — | |
| SCHEMBL7657379 | 0.85 | APLNR (0.31) | — | |
| SCHEMBL7654413 | 0.83 | BRS3 (0.32) | — | |
| SCHEMBL7924639 | 0.81 | BRS3 (0.30) | — | |
| SCHEMBL7652907 | 0.80 | BRS3 (0.30) | — | |
| SCHEMBL7650688 | 0.77 | AGTR1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6358984-B1 | FOR THERAPY OF HYPERTENSION AND/OR DISEASES SUCH AS HEART AND RENAL DISEASES | LEAD CHEMICAL CO., LTD. (JP) | 2002-03-19 | — | — | US | disclosed |
| US-6232335-B1 | A BIPHENYL TRIAZOLE COMPOUND USEFUL AS A ANGIOTENSIN II CONVERTING ENZYME INHIBITORS EFFECTIVE IN THE TREATMENT OF HYPERTENSION OR HEART FAILURE | LEAD CHEMICAL CO., LTD. (JP) | 2001-05-15 | — | — | US | disclosed |