⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16053285 | 0.65 | — | — | |
| SCHEMBL250871 | 0.65 | ALDH1A1 (0.33) | — | |
| SCHEMBL15148051 | 0.61 | ALDH1A1 (0.37) | — | |
| SCHEMBL1822293 | 0.61 | — | — | |
| SCHEMBL8965157 | 0.59 | — | — | |
| SCHEMBL15152323 | 0.59 | — | — | |
| SCHEMBL8074078 | 0.59 | — | — | |
| SCHEMBL20506888 | 0.59 | — | — | |
| SCHEMBL8074082 | 0.59 | — | — | |
| SCHEMBL9495687 | 0.58 | — | — |
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 16 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3899088-A1 | METAL PRETREATMENT COMPOSITIONS CONTAINING PHENALKAMINE COMPOUNDS | Henkel AG & Co. KGaA (DE) | 2021-10-27 | — | — | EP | disclosed |
| US-20210317583-A1 | METAL PRETREATMENT COMPOSITIONS CONTAINING PHENALKAMINE COMPOUNDS | HENKEL AG & CO. KGAA (DE) | 2021-10-14 | — | — | US | disclosed |
| WO-2020131443-A1 | METAL PRETREATMENT COMPOSITIONS CONTAINING PHENALKAMINE COMPOUNDS | HENKEL AG & CO. KGAA (DE) | 2020-06-25 | — | — | WO | disclosed |
| US-20130247308-A1 | LAUNDRY DETERGENT COMPOSITION FOR LOW TEMPERATURE WASHING AND DISINFECTION | ECOLAB USA INC. (US) | 2013-09-26 | — | — | US | disclosed |
| EP-2462120-A1 | FUNGICIDAL DIPHENYL-SUBSTITUTED PYRIDAZINES | E. I. du Pont de Nemours and Company (US) | 2012-06-13 | — | — | EP | disclosed |
| US-20120135995-A1 | FUNGICIDAL DIPHENYL-SUBSTITUTED PYRIDAZINES | E.I. DUPONT DE NEMOURS AND COMPANY (US) | 2012-05-31 | — | — | US | disclosed |
| WO-2011017261-A1 | FUNGICIDAL DIPHENYL-SUBSTITUTED PYRIDAZINES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 2011-02-10 | — | — | WO | disclosed |
| US-6686325-B2 | SOIL ROMOVAL, CORROSION RESISTANCE | ECOLAB INC. | 2004-02-03 | — | — | US | disclosed |
| WO-2003078691-A2 | ALKALINE SENSITIVE METAL CLEANING COMPOSITION, METHOD FOR CLEANING AN ALKALINE SENSITIVE METAL SURFACE, AND WASHING FACILITY | ECOLAB INC. (US) | 2003-09-25 | — | — | WO | disclosed |
| US-20030176305-A1 | Alkaline sensitive metal cleaning composition, method for cleaning an alkaline sensitive metal surface, and washing facility | ECOLAB USA INC. | 2003-09-18 | — | — | US | disclosed |
| US-5972875-A | POURABLE AT AMBIENT TEMPERATURES; INCLUDES FROM ABOUT 3.5-30 MOLES OF ALKOXYLATED UNITS | AIR PRODUCTS AND CHEMICALS, INC. | 1999-10-26 | — | — | US | disclosed |
| EP-0804635-B1 | NON-SILICATED SOFT METAL SAFE PRODUCT | UNILEVER NV (NL) | 1999-04-07 | — | — | EP | disclosed |
| US-5710120-A | MIXTURE OF CALCIUM COMPOUND, SURFACTANT, ALPHA-HYDROXY CARBOXYLIC ACID, AND POTASSIUM OR SODIUM HYDROXIDE; NONCORROSIVE CLEANING COMPOUNDS | DIVERSEY LEVER, INC. (US) | 1998-01-20 | — | — | US | disclosed |
| EP-0804635-A1 | NON-SILICATED SOFT METAL SAFE PRODUCT | UNILEVER N.V. (NL) | 1997-11-05 | — | — | EP | disclosed |
| WO-1996000316-A1 | NON-SILICATED SOFT METAL SAFE PRODUCT | UNILEVER N.V. (NL) | 1996-01-04 | — | — | WO | disclosed |
| US-4544395-A | Cationic surface coating of flat glass | PILKINGTON BROTHERS LIMITED (GB) | 1985-10-01 | — | — | US | disclosed |