⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1794749 | 0.95 | — | — | |
| SCHEMBL189912 | 0.95 | — | — | |
| SCHEMBL28123087 | 0.91 | — | — | |
| SCHEMBL28967859 | 0.91 | — | — | |
| Propane SCHEMBL4430157 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL2778841 | 0.91 | — | — | |
| SCHEMBL28066773 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL3853343 | 0.91 | — | — | |
| SCHEMBL27853946 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL7343045 | 0.87 | — | — |
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 15 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0080934-B1 | (4-OXO-4H-(1)-BENZOPYRAN-8-YL)-ALKANOIC ACIDS, SALTS AND DERIVATIVES, PREPARATION AND MEDICINES CONTAINING THEM | LIPHA, LYONNAISE INDUSTRIELLE PHARMACEUTIQUE (FR) | 1988-01-13 | — | — | EP | claimed |
| EP-1674616-B1 | Amphoteric fluorescent whitening agents | BASF SE (DE) | 2012-09-19 | — | — | EP | disclosed |
| CN-102292365-A | Dispersed two-component polyurethane foams | — | 2011-12-21 | — | — | CN | disclosed |
| CN-101679574-A | Radiation-and thermally-crosslinking polyurethane systems comprising iminooxadiazinedione | BAYER MATERIALSCIENCE AG | 2010-03-24 | — | — | CN | disclosed |
| CN-101668782-A | Aromatic urethane acrylates with high refractive index | BAYER MATERIALSCIENCE AG | 2010-03-10 | — | — | CN | disclosed |
| CN-101657483-A | Radiation-crosslinking and thermally crosslinking PU systems based on poly (epsilon-caprolactone) polyester polyols | BAYER MATERIALSCIENCE AG | 2010-02-24 | — | — | CN | disclosed |
| US-7566349-B2 | Amphoteric fluorescent whitening agents | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2009-07-28 | — | — | US | disclosed |
| CN-101484542-A | Microporous coating based on polyurethane-polyurea | BAYER MATERIALSCIENCE AG (DE) | 2009-07-15 | — | — | CN | disclosed |
| WO-2009051417-A2 | PHENANTHRENE LACTAM DERIVATIVES HAVING ANTICANCER ACTIVITY AND METHOD FOR THE PREPARATION THEREOF | KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) | 2009-04-23 | — | — | WO | disclosed |
| US-20070260060-A1 | Amphoteric fluorescent whitening agents | SCHEFFLER GOETZ | 2007-11-08 | — | — | US | disclosed |
| US-7247174-B2 | Amphoteric fluorescent whitening agents | CIBA SPECIALTY CHEMICALS CORPORATION (US) | 2007-07-24 | — | — | US | disclosed |
| US-20060155124-A1 | Amphoteric fluorescent whitening agents | CIBA SPECIALTY CHEMICALS CORP. | 2006-07-13 | — | — | US | disclosed |
| EP-1674616-A2 | Amphoteric fluorescent whitening agents | Ciba Specialty Chemicals Holding Inc. (CH) | 2006-06-28 | — | — | EP | disclosed |
| EP-1563049-A2 | AMPHOTERIC FLUORESCENT WHITENING AGENTS | Ciba SC Holding AG (CH) | 2005-08-17 | — | — | EP | disclosed |
| WO-2004046293-A2 | AMPHOTERIC FLUORESCENT WHITENING AGENTS | CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) | 2004-06-03 | — | — | WO | disclosed |