⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10535249 | 1.00 | — | — | |
| SCHEMBL242912 | 1.00 | — | — | |
| SCHEMBL13852631 | 1.00 | — | — | |
| SCHEMBL10538673 | 1.00 | — | — | |
| SCHEMBL7512757 | 1.00 | — | — | |
| SCHEMBL7515745 | 1.00 | — | — | |
| SCHEMBL7521221 | 1.00 | — | — | |
| SCHEMBL7525838 | 1.00 | — | — | |
| SCHEMBL7440928 | 0.87 | TSHR (0.53) | — | |
| SCHEMBL8768820 | 0.87 | TSHR (0.53) | — |
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-20090124601-A1 | Tartaric Acid Salts of a Dipeptidyl Peptidase-IV Inhibitor | MERCK & CO., INC. | 2009-05-14 | — | — | US | disclosed |
| EP-1498147-A1 | Absorbable biocompatible block copolymer | Eidgenössische Technische Hochschule Zürich (CH) | 2005-01-19 | — | — | EP | disclosed |