⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16933875 | 0.92 | — | — | |
| SCHEMBL4453651 | 0.89 | — | — | |
| SCHEMBL4454743 | 0.86 | SHBG (0.33) | — | |
| SCHEMBL614313 | 0.84 | — | — | |
| SCHEMBL31094806 | 0.77 | EPHX1 (0.30) | — | |
| SCHEMBL7022582 | 0.72 | — | — | |
| SCHEMBL10581759 | 0.67 | — | — | |
| SCHEMBL15911102 | 0.67 | EPHX1 (0.33) | — | |
| SCHEMBL3811607 | 0.67 | EPHX1 (0.41) | — | |
| SCHEMBL8079276 | 0.67 | EPHX1 (0.41) | — |
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-0647237-A1 | DOUBLE CHAIN PEPTIDE COMPOUNDS HAVING HEMOREGULATORY ACTIVITY | NYCOMED IMAGING AS (NO) | 1995-04-12 | — | — | EP | disclosed |
| WO-1993024522-A1 | DOUBLE CHAIN PEPTIDE COMPOUNDS HAVING HEMOREGULATORY ACTIVITY | HAFSLUND NYCOMED AS (NO) | 1993-12-09 | — | — | WO | disclosed |