SCHEMBL6570240

SCHEMBL6570240

C=C(C)C(=O)N(C)CC[N+](C)(CCCS(=O)(=O)O)C(C(=O)O)[N+](C)(C)C

nearest known ligand 0.00

⚠ 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.

Compoundsimilaritytop predictedshared targets
SCHEMBL17699504 0.75
SCHEMBL24136312 0.73 APP (0.33)
SCHEMBL28767331 0.72 EPHX2 (0.33)
SCHEMBL8763042 0.71 PTGS1 (0.30)
Ammonia Solution, Strong SCHEMBL18139365 0.70
SCHEMBL23837098 0.66 ACHE (0.35)
SCHEMBL640963 0.65 ENPP2 (0.33)
Betaine SCHEMBL6384849 0.64 TSHR (0.33)
SCHEMBL742679 0.64 USP2 (0.33)
SCHEMBL3342370 0.64 APP (0.35)

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1406994-A1 CLEANING COMPOSITIONS AND METHOD FOR CLEANING CARPETS AND OTHER MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2004-04-14 EP claimed
US-20030109399-A1 Cleaning compositions containing nanolatex, peroxygen bleach and/or fluorinated compounds and method for cleaning carpets and other materials THE PROCTER & GAMBLE COMPANY 2003-06-12 US claimed
US-20030092589-A1 Cleaning compositions and method for cleaning carpets and other materials THE PROCTER & GAMBLE COMPANY 2003-05-15 US claimed
WO-2003006596-A1 CLEANING COMPOSITIONS AND METHOD FOR CLEANING CARPETS AND OTHER MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2003-01-23 WO claimed
EP-1406992-A1 CLEANING COMPOSITIONS CONTAINING NANOLATEX, PEROXYGEN BLEACH AND/OR FLUORINATED COMPOUNDS AND METHOD FOR CLEANING CARPETS THE PROCTER & GAMBLE COMPANY (US) 2004-04-14 EP disclosed
EP-1406994-A1 CLEANING COMPOSITIONS AND METHOD FOR CLEANING CARPETS AND OTHER MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2004-04-14 EP disclosed
US-20030109399-A1 Cleaning compositions containing nanolatex, peroxygen bleach and/or fluorinated compounds and method for cleaning carpets and other materials THE PROCTER & GAMBLE COMPANY 2003-06-12 US disclosed
US-20030092589-A1 Cleaning compositions and method for cleaning carpets and other materials THE PROCTER & GAMBLE COMPANY 2003-05-15 US disclosed
WO-2003014276-A1 CLEANING COMPOSITIONS CONTAINING NANOLATEX, PEROXYGEN BLEACH AND/OR FLUORINATED COMPOUNDS AND METHOD FOR CLEANING CARPETS THE PROCTER & GAMBLE COMPANY (US) 2003-02-20 WO disclosed
WO-2003006596-A1 CLEANING COMPOSITIONS AND METHOD FOR CLEANING CARPETS AND OTHER MATERIALS THE PROCTER & GAMBLE COMPANY (US) 2003-01-23 WO disclosed