⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10346112 | 0.73 | — | — | |
| SCHEMBL10346113 | 0.73 | — | — | |
| SCHEMBL5552506 | 0.66 | — | — | |
| SCHEMBL7345899 | 0.66 | — | — | |
| SCHEMBL10346298 | 0.66 | — | — | |
| SCHEMBL7516285 | 0.65 | TDP1 (0.30) | — | |
| SCHEMBL8891434 | 0.65 | — | — | |
| SCHEMBL1934241 | 0.64 | MEN1 (0.32) | — | |
| SCHEMBL10597822 | 0.61 | NAAA (0.38) | — | |
| SCHEMBL8595891 | 0.60 | — | — |
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-1861397-A2 | PRODUCTION OF DOLASETRON | TEVA Gyógyszergyár Zártkörüen Müködö Részvénytársaság (HU) | 2007-12-05 | — | — | EP | disclosed |
| WO-2007081890-A2 | PRODUCTION OF DOLASETRON | TEVA GYÓGYSZERGYÁR ZÁRTKÖRÜEN MÜKÖDÖ RÉSZVÉNYTÁRSASÁG (HU) | 2007-07-19 | — | — | WO | disclosed |