SCHEMBL688298

SCHEMBL688298

CCCCCCCC/C=C\CCCCCCCCN1CC(OC(=O)O)CC1=O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 3/20 0.42
FAAH O00519 3/20 0.42
ALDH1A1 P00352 2/20 0.40
TERT O14746 3/20 0.39
PTPN1 P18031 3/20 0.39
PPARG P37231 3/20 0.39
PPARD Q03181 3/20 0.39
PPARA Q07869 3/20 0.39
TOP1 P11387 3/20 0.39
MAPT P10636 2/20 0.39
BLM P54132 2/20 0.39
HSD17B10 Q99714 2/20 0.39
FABP4 P15090 2/20 0.39
GMNN O75496 1/20 0.39
USP2 O75604 1/20 0.39
LMNA P02545 1/20 0.39
CYP1A2 P05177 1/20 0.39
POLB P06746 1/20 0.39
CYP2C9 P11712 1/20 0.39
ALOX15 P16050 1/20 0.39

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
SCHEMBL3669603 0.92 ALDH1A1 (0.45) ALDH1A1CYP2C19KMT2AGBA1L3MBTL1
SCHEMBL2719198 0.92 ALDH1A1 (0.45) ALDH1A1CYP2C19KMT2AGBA1L3MBTL1
SCHEMBL3700318 0.87 L3MBTL1 (0.47) ALDH1A1CYP1A2POLBCYP2C9CYP2C19
SCHEMBL3840857 0.84 MEN1 (0.39) MGLLFAAHALDH1A1LMNACYP2C9
SCHEMBL1360713 0.81 POLB (0.49) MGLLFAAHTERTPTPN1PPARG
SCHEMBL688297 0.81 POLB (0.49) MGLLFAAHTERTPTPN1PPARG
SCHEMBL7768685 0.78 SMN1; SMN2 (0.37) ALDH1A1BLMPOLBAPEX1ATM
SCHEMBL28408769 0.77 L3MBTL1 (0.46) MGLLFAAHCYP2C19KMT2AGBA1
SCHEMBL2889307 0.75 POLB (0.49) MGLLFAAHMAPTPOLBCYP2C19
Monoethanolamine SCHEMBL2889305 0.75 L3MBTL1 (0.43) MGLLFAAHMAPTBLMHSD17B10

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2480071-A1 PESTICIDE PREPARATIONS CONTAINING DERIVATIVES OF PYRROLIDONE-4-CARBOXYLIC ACID Clariant Finance (BVI) Limited (VG) 2012-08-01 EP disclosed
EP-2318568-B1 CORROSION INHIBITORS HAVING INCREASED BIOLOGICAL DEGRADABILITY AND MINIMIZED TOXICITY CLARIANT FINANCE BVI LTD (VG) 2012-05-16 EP disclosed
WO-2012024042-A3 CLOSURE ASSEMBLIES FOR MOVABLE PARTITIONS, MOVABLE PARTITION SYSTEMS INCLUDING CLOSURE ASSEMBLIES AND RELATED METHODS WON-DOOR CORPORATION (US) 2012-05-10 WO disclosed
EP-2445624-A1 WATER IN OIL EMULSION, METHOD FOR THE PRODUCTION THEREOF Clariant Finance (BVI) Limited (VG) 2012-05-02 EP disclosed
EP-2022781-B1 1-Alkyl-5-oxo-pyrrolidine-3-carboxylic acid esters with improved biodegradability CLARIANT FINANCE BVI LTD (VG) 2012-02-29 EP disclosed
EP-2242872-B1 CORROSION INHIBITORS HAVING INCREASED BIOLOGICAL DEGRADABILITY AND MINIMIZED TOXICITY CLARIANT FINANCE BVI LTD (VG) 2011-12-07 EP disclosed
WO-2011035873-A1 PESTICIDE PREPARATIONS CONTAINING DERIVATIVES OF PYRROLIDONE-4-CARBOXYLIC ACID CLARIANT INTERNATIONAL LTD (CH) 2011-03-31 WO disclosed
WO-2010149251-A1 WATER IN OIL EMULSION, METHOD FOR THE PRODUCTION THEREOF CLARIANT INTERNATIONAL LTD (CH) 2010-12-29 WO disclosed
EP-2242872-A1 CORROSION INHIBITORS HAVING INCREASED BIOLOGICAL DEGRADABILITY AND MINIMIZED TOXICITY Clariant Finance (BVI) Limited (VG) 2010-10-27 EP disclosed
WO-2009086873-A1 CORROSION INHIBITORS HAVING INCREASED BIOLOGICAL DEGRADABILITY AND MINIMIZED TOXICITY CLARIANT INTERNATIONAL LTD (CH) 2009-07-16 WO disclosed
WO-2009086872-A1 CORROSION INHIBITORS HAVING INCREASED BIOLOGICAL DEGRADABILITY AND MINIMIZED TOXICITY CLARIANT INTERNATIONAL LTD (CH) 2009-07-16 WO disclosed
EP-2028247-A1 Use of 1-alkyl-5-oxo-pyrrolidine-3-carbolic acid esters as gas hydrate inhibitors with improved biological degradability CLARIANT INTERNATIONAL LTD. (CH) 2009-02-25 EP disclosed
EP-2022781-A1 1-Alkyl-5-oxo-pyrrolidine-3-carboxylic acid esters with improved biodegradability CLARIANT INTERNATIONAL LTD. (CH) 2009-02-11 EP disclosed