⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3024502 | 0.99 | — | — | |
| SCHEMBL3016621 | 0.90 | — | — | |
| SCHEMBL13214421 | 0.86 | DRD3 (0.35) | — | |
| SCHEMBL10044305 | 0.81 | DRD3 (0.31) | — | |
| SCHEMBL13190893 | 0.76 | — | — | |
| SCHEMBL13234762 | 0.75 | DRD3 (0.30) | — | |
| SCHEMBL13214424 | 0.74 | DRD3 (0.33) | — | |
| SCHEMBL3021494 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL3016482 | 0.74 | ALDH1A1 (0.36) | — | |
| SCHEMBL13929110 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2408930-B1 | BIOTINIDASE ASSAY | WALLAC OY (FI) | 2015-05-06 | — | — | EP | disclosed |
| US-20120045784-A1 | BIOTINIDASE ASSAY | Joachim Ngiamas trustee for Joachim Ngiam Trust Fund ABN | 2012-02-23 | — | — | US | disclosed |
| EP-2408930-A2 | BIOTINIDASE ASSAY | WALLAC OY (FI) | 2012-01-25 | — | — | EP | disclosed |
| WO-2010106222-A2 | BIOTINIDASE ASSAY | WALLAC OY (FI) | 2010-09-23 | — | — | WO | disclosed |