⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25442 | 0.95 | — | — | |
| SCHEMBL1706581 | 0.91 | ALDH1A1 (0.50) | — | |
| SCHEMBL29931207 | 0.91 | — | — | |
| Hydrogen Peroxide SCHEMBL8626398 | 0.91 | ALDH1A1 (0.50) | — | |
| SCHEMBL2991355 | 0.91 | — | — | |
| SCHEMBL30477387 | 0.91 | — | — | |
| SCHEMBL29877272 | 0.91 | — | — | |
| Acetone SCHEMBL226043 | 0.91 | LMNA (0.55) | — | |
| Bicarbonate SCHEMBL7771639 | 0.87 | ALDH1A1 (0.47) | — | |
| Bicarbonate SCHEMBL7103822 | 0.87 | ALDH1A1 (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-101269236-B | Fluid storage material including particles secured with a crosslinkable binder composition | KIMBERLY CLARK GLOBAL CO LTD | 2012-09-26 | — | — | CN | disclosed |
| CN-101269236-A | Fluid storage material including particles secured with a crosslinkable binder composition | KIMBERLY CLARK GLOBAL CO LTD (US) | 2008-09-24 | — | — | CN | disclosed |
| CN-100396337-C | Fluid storage material comprising particles immobilized with a cross-linkable adhesive composition | KIMBERLY CLARK CO (US) | 2008-06-25 | — | — | CN | disclosed |
| CN-1668344-A | Fluid storage material comprising particles immobilized with a cross-linkable adhesive composition | KIMBERLY CLARK CO (US) | 2005-09-14 | — | — | CN | disclosed |