⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12328299 | 1.00 | — | — | |
| Bromide SCHEMBL6652487 | 0.96 | TSHR (0.40) | — | |
| Hydrochloric Acid SCHEMBL5461992 | 0.96 | TSHR (0.40) | — | |
| SCHEMBL4221722 | 0.82 | TSHR (0.50) | — | |
| SCHEMBL15081070 | 0.77 | — | — | |
| SCHEMBL93450 | 0.75 | — | — | |
| SCHEMBL13002150 | 0.74 | FDPS (0.36) | — | |
| Hydrochloric Acid SCHEMBL16236771 | 0.74 | TSHR (0.35) | — | |
| SCHEMBL1725 | 0.73 | — | — | |
| SCHEMBL155400 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2024028620-A2 | SELECTIVE FLUORESCENT PROBES FOR MEASURING MULTIDRUG TRANSPORTER ACTIVITY | Természettudományi Kutatóközpont (HU) | 2024-02-08 | — | — | WO | disclosed |
| WO-2021097057-A1 | 5-MEMBERED HETEROARYLAMINOSULFONAMIDES FOR TREATING CONDITIONS MEDIATED BY DEFICIENT CFTR ACTIVITY | GENZYME CORPORATION (US) | 2021-05-20 | — | — | WO | disclosed |
| US-7391603-B2 | Electric double layer capacitor and electrolytic solution therefor | HONDA MOTOR CO., LTD. (JP) | 2008-06-24 | — | — | US | disclosed |
| US-20060262485-A1 | Electric double layer capacitor and electrolytic solution therefor | MITSUBISHI CHEMICAL CORPORATION (JP) | 2006-11-23 | — | — | US | disclosed |