SCHEMBL5168959

SCHEMBL5168959

CCCCCCC/C=C/C(=O)OCC.CCCCCCCCCC(=O)OCC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.59
CYP3A4 P08684 1/20 0.59
ALOX15 P16050 1/20 0.59
TSHR P16473 1/20 0.59
HSD17B10 Q99714 1/20 0.59
TDP1 Q9NUW8 1/20 0.59
MAPT P10636 1/20 0.57
FAAH O00519 2/20 0.56
DGKA P23743 2/20 0.54
PRKCE Q02156 1/20 0.51
PRKCQ Q04759 1/20 0.51
PRKCD Q05655 1/20 0.51
PRKCA P17252 1/20 0.51
PPARG P37231 2/20 0.50
PPARA Q07869 2/20 0.50
NR1I2 O75469 1/20 0.50
PGR P06401 1/20 0.50
ADORA3 P0DMS8 1/20 0.50
PTGS2 P35354 1/20 0.50
PDE4D Q08499 1/20 0.50

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
SCHEMBL5168966 1.00 ALDH1A1 (0.59) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL29980649 0.95 MAPT (0.58) ALDH1A1CYP3A4ALOX15TSHRHSD17B10
SCHEMBL1468542 0.90 MAPT (0.68) ALDH1A1ALOX15HSD17B10MAPTFAAH
SCHEMBL6308014 0.90 MAPT (0.68) ALDH1A1ALOX15HSD17B10MAPTFAAH
SCHEMBL1503665 0.90 MAPT (0.68) ALDH1A1ALOX15HSD17B10MAPTFAAH
SCHEMBL25404144 0.90 MAPT (0.68) ALDH1A1ALOX15HSD17B10MAPTFAAH
SCHEMBL25406757 0.90 MAPT (0.68) ALDH1A1ALOX15HSD17B10MAPTFAAH
SCHEMBL11795363 0.90 MAPT (0.68) ALDH1A1ALOX15HSD17B10MAPTFAAH
SCHEMBL21027289 0.90 MAPT (0.68) ALDH1A1ALOX15HSD17B10MAPTFAAH
SCHEMBL873713 0.90 MAPT (0.68) ALDH1A1ALOX15HSD17B10MAPTFAAH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1328161-B1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2007-04-18 EP claimed
EP-1282368-B1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2005-07-27 EP claimed
US-6599548-B2 Tea extract and a preservative system of cinnamic acid, essential oils and pasteurization adjuncts that become fungicidal when heatactivated LIPTON, DIVISION OF CONOPCO, INC. 2003-07-29 US claimed
EP-1328161-A2 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2003-07-23 EP claimed
US-6579556-B2 Heating to activate fungicide LIPTON, DIVISION OF CONOPCO, INC. 2003-06-17 US claimed
EP-1282368-A1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2003-02-12 EP claimed
US-20020034568-A1 Ambient stable beverage LIPTON, DIVISION OF CONOPCO, INC. 2002-03-21 US claimed
US-20010055644-A1 Ambient stable beverage LIPTON, DIVISION OF CONOPCO, INC. 2001-12-27 US claimed
WO-2001087080-A2 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2001-11-22 WO claimed
WO-2001087094-A1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2001-11-22 WO claimed
EP-1328161-B1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2007-04-18 EP disclosed
EP-1282368-B1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2005-07-27 EP disclosed
US-6599548-B2 Tea extract and a preservative system of cinnamic acid, essential oils and pasteurization adjuncts that become fungicidal when heatactivated LIPTON, DIVISION OF CONOPCO, INC. 2003-07-29 US disclosed
EP-1328161-A2 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2003-07-23 EP disclosed
US-6579556-B2 Heating to activate fungicide LIPTON, DIVISION OF CONOPCO, INC. 2003-06-17 US disclosed
EP-1282368-A1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2003-02-12 EP disclosed
US-20020034568-A1 Ambient stable beverage LIPTON, DIVISION OF CONOPCO, INC. 2002-03-21 US disclosed
US-20010055644-A1 Ambient stable beverage LIPTON, DIVISION OF CONOPCO, INC. 2001-12-27 US disclosed
WO-2001087080-A2 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2001-11-22 WO disclosed
WO-2001087094-A1 AMBIENT STABLE BEVERAGE UNILEVER PLC (GB) 2001-11-22 WO disclosed