⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL735595 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL10481904 | 0.91 | — | — | |
| SCHEMBL15779512 | 0.91 | — | — | |
| SCHEMBL28104801 | 0.70 | — | — | |
| SCHEMBL28982553 | 0.68 | — | — | |
| SCHEMBL3677673 | 0.67 | — | — | |
| SCHEMBL5802816 | 0.67 | — | — | |
| SCHEMBL3182198 | 0.67 | — | — | |
| SCHEMBL1303671 | 0.67 | — | — | |
| SCHEMBL1304594 | 0.67 | — | — |
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-0434979-A1 | Peptide derivatives useful as antagonists of bombesin and gastrin-releasing peptide | MERRELL DOW PHARMACEUTICALS INC. (US) | 1991-07-03 | — | — | EP | disclosed |
| EP-0376550-A2 | Stabilized solid thiocarbonate compositions and methods for making same | UNION OIL COMPANY OF CALIFORNIA (US) | 1990-07-04 | — | — | EP | disclosed |