SCHEMBL5047693

SCHEMBL5047693

CC(CCCC(=O)O)OON1C(=O)c2ccccc2C1=O

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.46
KDM4E B2RXH2 1/20 0.46
TP53 P04637 1/20 0.46
GLA P06280 1/20 0.46
POLB P06746 1/20 0.46
CYP3A4 P08684 1/20 0.46
CYP2D6 P10635 1/20 0.46
HPGD P15428 1/20 0.46
ALOX12 P18054 1/20 0.46
NFKB1 P19838 1/20 0.46
APEX1 P27695 1/20 0.46
MAPK1 P28482 1/20 0.46
HSD17B10 Q99714 1/20 0.46
CYP1A2 P05177 1/20 0.40
CYP2C9 P11712 1/20 0.40
PPARG P37231 1/20 0.40
CA12 O43570 1/20 0.40
CA9 Q16790 1/20 0.40
LMNA P02545 1/20 0.38
PPARD Q03181 1/20 0.38

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
SCHEMBL3001320 0.83 TNF (0.46) ALDH1A1KDM4ETP53GLAPOLB
SCHEMBL309713 0.80 ALDH1A1 (0.42) ALDH1A1KDM4ETP53GLAPOLB
Hexanoate SCHEMBL27567437 0.77 AKR1B1 (0.48) ALDH1A1HSD17B10CYP1A2CYP2C9PPARG
SCHEMBL4870153 0.76 GAA (0.43) ALDH1A1KDM4EPOLBHPGDCYP1A2
SCHEMBL1531985 0.76 PPARG (0.50) ALDH1A1KDM4ETP53GLAPOLB
SCHEMBL8980783 0.75 LMNA (0.45) ALDH1A1KDM4ETP53GLAPOLB
SCHEMBL1532120 0.74 PPARG (0.46) ALDH1A1KDM4ETP53GLAPOLB
SCHEMBL10409030 0.74 POLB (0.57) ALDH1A1KDM4ETP53GLAPOLB
SCHEMBL26480 0.73 PPARG (0.45) ALDH1A1KDM4ETP53GLAPOLB
SCHEMBL1532004 0.73 PPARG (0.45) ALDH1A1KDM4ETP53GLAPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7445643-B2 Automatic machine laundering of fabrics THE PROCTER & GAMBLE COMPANY (US) 2008-11-04 US disclosed
EP-1699912-A1 AUTOMATIC MACHINE LAUNDERING OF FABRICS The Procter and Gamble Company (US) 2006-09-13 EP disclosed
WO-2005061685-A1 AUTOMATIC MACHINE LAUNDERING OF FABRICS THE PROCTER & GAMBLE COMPANY (US) 2005-07-07 WO disclosed
US-20050124521-A1 Automatic machine laundering of fabrics THE PROCTER & GAMBLE COMPANY 2005-06-09 US disclosed
US-20040167051-A1 Dishwasher machine detergents with low viscosity surfactants HENKEL AG & CO. KGAA (DE) 2004-08-26 US disclosed