⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20555777 | 0.71 | LRRK2 (0.39) | — | |
| SCHEMBL2611135 | 0.69 | LRRK2 (0.32) | — | |
| SCHEMBL21148772 | 0.68 | — | — | |
| SCHEMBL6020795 | 0.67 | — | — | |
| SCHEMBL11595790 | 0.67 | — | — | |
| SCHEMBL31727821 | 0.67 | — | — | |
| SCHEMBL14375518 | 0.67 | LRRK2 (0.37) | — | |
| SCHEMBL14417139 | 0.65 | LRRK2 (0.34) | — | |
| SCHEMBL31728188 | 0.65 | — | — | |
| SCHEMBL13314652 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8623898-B2 | Glycine transporter inhibiting substances | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2014-01-07 | — | — | US | disclosed |
| US-20120010414-A1 | GLYCINE TRANSPORTER INHIBITING SUBSTANCES | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2012-01-12 | — | — | US | disclosed |
| US-20120010414-A1 | GLYCINE TRANSPORTER INHIBITING SUBSTANCES | TAISHO PHARMACEUTICAL CO., LTD. (JP) | 2012-01-12 | — | — | US | disclosed |