⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7968964 | 0.74 | SHBG (0.37) | — | |
| SCHEMBL8232714 | 0.74 | — | — | |
| SCHEMBL17929724 | 0.70 | HSD17B10 (0.38) | — | |
| SCHEMBL31457129 | 0.68 | CYP1A2 (0.41) | — | |
| SCHEMBL5868515 | 0.68 | — | — | |
| SCHEMBL10305024 | 0.68 | — | — | |
| SCHEMBL13575858 | 0.67 | — | — | |
| SCHEMBL1526832 | 0.67 | — | — | |
| SCHEMBL10112507 | 0.65 | CA1 (0.33) | — | |
| SCHEMBL15471412 | 0.65 | — | — |
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-20080275241-A1 | Polymorphic Forms of Dolasetron Base and Processes of Preparing Dolasetron Base, Its Polymorphic Forms and Salt Thereof | USV LIMITED (IN) | 2008-11-06 | — | — | US | disclosed |
| WO-2007072507-A2 | POLYMORPHIC FORMS OF DOLASETRON BASE AND PROCESSES OF PREPARING DOLASETRON BASE, ITS POLYMORPHIC FORMS AND SALT THEREOF | USV LIMITED (IN) | 2007-06-28 | — | — | WO | disclosed |