SCHEMBL440516

SCHEMBL440516

CCCC(C)CC(C)CCCC(=O)O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.48
AKR1B1 P15121 1/20 0.48
GPR84 Q9NQS5 7/20 0.46
PPARG P37231 7/20 0.46
PPARD Q03181 7/20 0.46
PPARA Q07869 7/20 0.46
HDAC11 Q96DB2 5/20 0.46
TSHR P16473 4/20 0.46
PTPN1 P18031 3/20 0.46
TLR2 O60603 2/20 0.46
TDP1 Q9NUW8 2/20 0.46
FABP4 P15090 2/20 0.46
FFAR1 O14842 2/20 0.46
FFAR4 Q5NUL3 2/20 0.46
SLC22A6 Q4U2R8 1/20 0.46
SLC22A8 Q8TCC7 1/20 0.46
MEN1 O00255 1/20 0.46
ESR1 P03372 1/20 0.46
ALOX15 P16050 1/20 0.46
PDE4A P27815 1/20 0.46

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
SCHEMBL4003119 0.91 AKR1B1 (0.52) ALDH1A1AKR1B1GPR84PPARGPPARD
Hydrochloric Acid SCHEMBL7382963 0.89 ALDH1A1 (0.50) ALDH1A1AKR1B1GPR84PPARGPPARD
SCHEMBL1301986 0.88 MAPT (0.50) ALDH1A1AKR1B1GPR84PPARGPPARD
SCHEMBL2574528 0.88 MAPT (0.50) ALDH1A1AKR1B1GPR84PPARGPPARD
SCHEMBL14359840 0.87 GABRP (0.48) ALDH1A1AKR1B1GPR84TSHRFFAR1
SCHEMBL4221144 0.87 GABRP (0.48) ALDH1A1AKR1B1GPR84PPARGPPARD
SCHEMBL3629224 0.85 ALDH1A1 (0.60) ALDH1A1AKR1B1GPR84PPARGPPARD
SCHEMBL2803052 0.84 FFAR4 (0.61) ALDH1A1AKR1B1GPR84PPARGPPARD
SCHEMBL5417161 0.84 FFAR4 (0.67) ALDH1A1AKR1B1GPR84PPARGPPARD
SCHEMBL1457100 0.83 ALDH1A1 (0.63) ALDH1A1AKR1B1GPR84PPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188030-B2 Fabric softener compositions and methods of manufacture thereof SEGETIS, INC. (US) 2012-05-29 US disclosed
US-20120065113-A1 FABRIC SOFTENER COMPOSITIONS AND METHODS OF MANUFACTURE THEREOF SEGETIS, INC. (US) 2012-03-15 US disclosed
CN-1232692-C Concentrated & stable fabric softening composition containing chelant PROCTER & GAMBLE (US) 2005-12-21 CN disclosed
US-20050202998-A1 Concentrated, stable, translucent or clear, fabric softening compositions including chelants THE PROCTER & GAMBLE COMPANY 2005-09-15 US disclosed
US-6943144-B1 Concentrated stable, translucent or clear fabric softening compositions including chelants THE PROCTER & GAMBLE COMPANY (US) 2005-09-13 US disclosed
US-6855229-B2 Low viscosity bilayer disrupted softening composition for tissue paper THE PROCTER & GAMBLE COMPANY (US) 2005-02-15 US disclosed
US-20040188045-A1 Low viscosity bilayer disrupted softening composition for tissue paper THE PROCTER & GAMBLE COMPANY 2004-09-30 US disclosed
US-6797117-B1 DISPERSION CONTAINING QUARTERNARY AMMONIUM COMPOUND, NONIONIC SURFACTANT, ELECTROLYTE AND VEHICLE; PAPER MACHINE WET END ADDITIVE; RETAINS STRENGTH AND ABSORBENCY THE PROCTER & GAMBLE COMPANY 2004-09-28 US disclosed
US-20040144511-A1 Low viscosity bilayer disrupted softening composition for tissue paper MCKAY DAVID D (US) 2004-07-29 US disclosed
CN-1436890-A Concentrated & stable fabric softening composition containing chelant PROCTER & GAMBLE (US) 2003-08-20 CN disclosed
EP-1131486-B1 PROCESS FOR MAKING SOFT TISSUE PAPER PROCTER & GAMBLE (US) 2003-07-23 EP disclosed
CN-1323368-A Process for making soft tissue paper PROCTER & GAMBLE (US) 2001-11-21 CN disclosed
CN-1219953-A Fabric softening compound/composition PROCTER & GAMBLE (US) 1999-06-16 CN disclosed
EP-0888424-A1 FABRIC SOFTENING COMPOUND/COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1999-01-07 EP disclosed
CN-1196082-A Concentrated stable fabric softening compositions comprising chelants PROCTER & GAMBLE (US) 1998-10-14 CN disclosed
EP-0839180-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITIONS INCLUDING CHELANTS THE PROCTER & GAMBLE COMPANY (US) 1998-05-06 EP disclosed
US-5747443-A BIODEGRADABLE QUATERNARY AMMONIUM COMPOUNDS THE PROCTER & GAMBLE COMPANY (US) 1998-05-05 US disclosed
WO-1997034972-A1 FABRIC SOFTENING COMPOUND/COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 1997-09-25 WO disclosed
WO-1997003172-A1 CONCENTRATED, STABLE FABRIC SOFTENING COMPOSITIONS INCLUDING CHELANTS THE PROCTER & GAMBLE COMPANY (US) 1997-01-30 WO disclosed