⚠ 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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL9436488 | 0.95 | CA1 (0.40) | — | |
| SCHEMBL30960095 | 0.95 | CA1 (0.40) | — | |
| SCHEMBL30514 | 0.95 | — | — | |
| SCHEMBL1690429 | 0.90 | CA1 (0.36) | — | |
| SCHEMBL4235388 | 0.90 | CA1 (0.36) | — | |
| SCHEMBL7749080 | 0.90 | — | — | |
| SCHEMBL1155717 | 0.90 | CA1 (0.36) | — | |
| Ammonia Solution, Strong SCHEMBL1160872 | 0.90 | CA1 (0.36) | — | |
| Bicarbonate SCHEMBL11048608 | 0.90 | CA1 (0.50) | — | |
| Water SCHEMBL28937858 | 0.90 | — | — |
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-7384787-B2 | Increasing perhydrolase activity in esterases and/or lipases | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2008-06-10 | — | — | US | disclosed |
| US-20060286651-A1 | INCREASING PERHYDROLASE ACTIVITY IN ESTERASES AND/OR LIPASES | REGENTS OF THE UNIVERSITY OF MINNESOTA | 2006-12-21 | — | — | US | disclosed |
| WO-2006133079-A2 | INCREASING PERHYDROLASE ACTIVITY IN ESTERASES AND/OR LIPASES | REGENTS OF THE UNIVERSITY OF MINNESOTA (US) | 2006-12-14 | — | — | WO | disclosed |