SCHEMBL5874374

SCHEMBL5874374

CCOC(CC)(CC)C(=O)[O-].CCOC(CC)(CC)C(=O)[O-].CCOC(CC)(CC)C(=O)[O-].[Al+3]

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.31

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
SCHEMBL3258251 0.75 SOAT1 (0.36) ALDH1A1
SCHEMBL24780286 0.73 SOAT1 (0.35) ALDH1A1
SCHEMBL28056608 0.73 ALDH1A1 (0.32) ALDH1A1
SCHEMBL28324952 0.73 SOAT1 (0.35) ALDH1A1
SCHEMBL29035551 0.71 ALDH1A1 (0.31) ALDH1A1
SCHEMBL27793139 0.71 CYP4F2 (0.42) ALDH1A1
SCHEMBL13776376 0.71 DGAT1 (0.33) ALDH1A1
Potassium Ion SCHEMBL11217407 0.70 ALDH1A1 (0.33) ALDH1A1
SCHEMBL11485784 0.68 FFAR3 (0.35) ALDH1A1
SCHEMBL26650 0.68 ALDH1A1 (0.32) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7125532-B2 Process for the manufacture of dispersible alumino-silicates SASOL GERMANY GMBH (DE) 2006-10-24 US disclosed
US-20020098142-A1 Hydrolysis of aluminum compounds and organosilicon compounds which are dispersable in aqueous and/or aqueous-acidic media BRASCH ANDREA (DE) 2002-07-25 US disclosed