SCHEMBL6733288

SCHEMBL6733288

CC(C)c1cc(C(C)C)cc(S(=O)(=O)O)c1.[NaH]

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FABP3 P05413 2/20 0.55
FABP4 P15090 2/20 0.55
FABP5 Q01469 1/20 0.55
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
LMNA P02545 2/20 0.39
ING2 Q9H160 1/20 0.39
ALDH1A1 P00352 6/20 0.38
TSHR P16473 3/20 0.38
NT5E P21589 2/20 0.38
SMN1; SMN2 Q16637 1/20 0.36
GABRA1 P14867 1/20 0.34
GABRB2 P47870 1/20 0.34
PGR P06401 1/20 0.34
HSD17B10 Q99714 3/20 0.33
TDP1 Q9NUW8 1/20 0.33
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA9 Q16790 1/20 0.33

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
SCHEMBL3136264 0.98 FABP3 (0.57) FABP3FABP4FABP5LCKFYN
SCHEMBL12014092 0.93 FABP3 (0.57) FABP3FABP4FABP5LCKFYN
SCHEMBL12014163 0.85 FABP3 (0.50) FABP3FABP4FABP5LCKFYN
SCHEMBL11799151 0.85 FABP3 (0.50) FABP3FABP4FABP5LCKFYN
Sulfuric Acid SCHEMBL30910258 0.83 FABP4 (0.60) FABP3FABP4FABP5LMNAALDH1A1
SCHEMBL20751961 0.81 FABP3 (0.46) FABP3FABP4FABP5LCKFYN
SCHEMBL9850308 0.79 ALDH1A1 (0.50) FABP3FABP4FABP5LMNAALDH1A1
SCHEMBL16923056 0.79 FABP3 (0.44) FABP3FABP4FABP5LCKFYN
SCHEMBL11042085 0.78 FABP4 (0.45) FABP3FABP4FABP5LMNAALDH1A1
SCHEMBL6903766 0.78 FABP4 (0.56) FABP3FABP4FABP5LMNAALDH1A1

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
US-20040224874-A1 Process for producing coated detergent particles JAGANNATH GIRISH (JP) 2004-11-11 US disclosed
US-6767882-B1 COATING DETERGENT GRANULES IN MIXER WITH SOLUTION OF WATER SOLUBLE SODIUM LINEAR ALKYLBENZENESULFONATE AND/OR HYDROPHOBIC SECONDARY ALKYL SULFATE ANIONIC SURFACTANT AND SODIUM XYLENE SULFONATE AND/OR ALKYLDIPHENYLOXIDE DISULFONATE HYDROTROPE THE PROCTER & GAMBLE COMPANY 2004-07-27 US disclosed
EP-1187902-A1 PROCESS FOR PRODUCING COATED DETERGENT PARTICLES THE PROCTER & GAMBLE COMPANY (US) 2002-03-20 EP disclosed
WO-2000078909-A1 PROCESS FOR PRODUCING COATED DETERGENT PARTICLES THE PROCTER & GAMBLE COMPANY (US) 2000-12-28 WO disclosed