SCHEMBL2232037

SCHEMBL2232037

C=C(CCC[AsH2])C(=O)N(C)C

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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
SCHEMBL696791 0.80 ALDH1A1 (0.54) ALDH1A1
SCHEMBL93437 0.78 CYP1A2 (0.41) ALDH1A1
SCHEMBL8437334 0.78 PAOX (0.36) ALDH1A1
SCHEMBL10867506 0.77 CES2 (0.48) ALDH1A1
SCHEMBL747178 0.77 PAOX (0.45) ALDH1A1
Chloromethane SCHEMBL534115 0.75 CYP1A2 (0.38) ALDH1A1
SCHEMBL15281928 0.75 PAOX (0.48) ALDH1A1
SCHEMBL429458 0.75 ALDH1A1 (0.41) ALDH1A1
Monoethanolamine SCHEMBL8703802 0.74 CYP1A2 (0.37) ALDH1A1
SCHEMBL10681875 0.73 ALDH1A1 (0.48) ALDH1A1

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2344517-A1 TEMPERATURE-RESPONSIVE POLYMER PARTICLES IN PROTEIN SEPARATION APPLICATIONS Commonwealth Scientific and Industrial Research Organisation (AU) 2011-07-20 EP disclosed
WO-2010031144-A1 TEMPERATURE-RESPONSIVE POLYMER PARTICLES IN PROTEIN SEPARATION APPLICATIONS COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) 2010-03-25 WO disclosed
EP-1877622-A2 HIGH MOLECULAR WEIGHT COMPACT STRUCTURED POLYMERS, METHODS OF MAKING AND USING Nalco Company (US) 2008-01-16 EP disclosed
WO-2006118875-A2 HIGH MOLECULAR WEIGHT COMPACT STRUCTURED POLYMERS, METHODS OF MAKING AND USING NALCO COMPANY (US) 2006-11-09 WO disclosed