⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24343760 | 0.83 | MAPT (0.35) | — | |
| Water SCHEMBL28694448 | 0.78 | MAPT (0.32) | — | |
| SCHEMBL9328691 | 0.78 | — | — | |
| SCHEMBL7684766 | 0.78 | — | — | |
| Hydrochloric Acid SCHEMBL28652633 | 0.77 | TDP1 (0.30) | — | |
| SCHEMBL10405921 | 0.76 | — | — | |
| SCHEMBL19016291 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL10333402 | 0.76 | THRB (0.35) | — | |
| SCHEMBL9076826 | 0.75 | FDPS (0.30) | — | |
| SCHEMBL19115988 | 0.75 | TDP1 (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1440109-A1 | OPTICAL BRIGHTENERS, THEIR COMPOSITION, THEIR PRODUCTION AND THEIR USE | Clariant Finance (BVI) Limited (VG) | 2004-07-28 | — | — | EP | disclosed |
| WO-2003033568-A1 | OPTICAL BRIGHTENERS, THEIR COMPOSITION, THEIR PRODUCTION AND THEIR USE | CLARIANT INTERNATIONAL LTD (CH) | 2003-04-24 | — | — | WO | disclosed |
| EP-1093538-A1 | POLYCATIONIC POLYMERS, THEIR PRODUCTION AND USE | Clariant Finance (BVI) Limited (VG) | 2001-04-25 | — | — | EP | disclosed |
| WO-1999067463-A1 | POLYCATIONIC POLYMERS, THEIR PRODUCTION AND USE | CLARIANT FINANCE (BVI) LIMITED (VG) | 1999-12-29 | — | — | WO | disclosed |
| EP-0707113-A1 | Process for making dry- and/or wet-resistant cellulose webs | BAYER AG (DE) | 1996-04-17 | — | — | EP | disclosed |