⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL218006 | 0.96 | — | — | |
| Furan SCHEMBL28186040 | 0.76 | MAPK1 (0.38) | — | |
| SCHEMBL11800713 | 0.76 | CYP1A2 (0.41) | — | |
| SCHEMBL1498136 | 0.71 | — | — | |
| SCHEMBL279830 | 0.69 | — | — | |
| SCHEMBL5838433 | 0.69 | — | — | |
| SCHEMBL11144350 | 0.69 | KDM5B (0.30) | — | |
| Ammonia Solution, Strong SCHEMBL6738777 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL27888557 | 0.67 | — | — | |
| SCHEMBL3667831 | 0.64 | — | — |
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-7345018-B2 | Method of treating side effects induced by therapeutic agents | RECEPTION APS (DK) | 2008-03-18 | — | — | US | disclosed |
| US-20030202974-A1 | Agents for the prevention of organ damage induced by therapeutic agents | MAX-DELBRUCK-CENTRUM FUR MOLEKULARE MEDIZIN | 2003-10-30 | — | — | US | disclosed |