⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12014172 | 0.74 | — | — | |
| Water SCHEMBL11438442 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL15574505 | 0.69 | — | — | |
| SCHEMBL12005489 | 0.67 | — | — | |
| SCHEMBL16766321 | 0.67 | — | — | |
| SCHEMBL1223459 | 0.67 | — | — | |
| SCHEMBL511927 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL1934796 | 0.63 | — | — | |
| SCHEMBL14764609 | 0.63 | — | — | |
| Water SCHEMBL1826623 | 0.63 | — | — |
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-5508382-A | SYNTHETIC CALCITONIN | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 1996-04-16 | — | — | US | disclosed |
| EP-0452514-B1 | PEPTIDE AND PROCESS FOR PREPARING CYCLIC PEPTIDE | DAICEL CHEM (JP) | 1995-07-05 | — | — | EP | disclosed |
| US-5428129-A | Cyclization in presence of an alkali metal salt | DAICEL CHEMICAL INDUSTRIES (JP) | 1995-06-27 | — | — | US | disclosed |
| EP-0452514-A1 | PEPTIDE AND PROCESS FOR PREPARING CYCLIC PEPTIDE | DAICEL CHEMICAL INDUSTRIES, LTD. (JP) | 1991-10-23 | — | — | EP | disclosed |