SCHEMBL17080353

SCHEMBL17080353

CCCCCCCCC=CCCCCCCCCc1ccc(C(=O)O)c(C(=O)O)c1CCCCCCCCCCCCCCCCCC

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F7 P08709 3/20 0.60
F3 P13726 3/20 0.60
MMP2 P08253 2/20 0.60
SAE1 Q9UBE0 2/20 0.60
KDM4E B2RXH2 1/20 0.60
MAPT P10636 1/20 0.60
ALOX15 P16050 1/20 0.60
ECE1 P42892 1/20 0.60
SGMS1 Q86VZ5 1/20 0.60
SGMS2 Q8NHU3 1/20 0.60
MUS81 Q96NY9 1/20 0.60
HSD17B10 Q99714 1/20 0.60
BID P55957 6/20 0.56
MCL1 Q07820 6/20 0.56
BCL2L1 Q07817 5/20 0.56
BAK1 Q16611 5/20 0.56
PPARA Q07869 3/20 0.47
KAT8 Q9H7Z6 2/20 0.47
PPARG P37231 1/20 0.47
EP300 Q09472 1/20 0.47

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
SCHEMBL17080352 1.00 F7 (0.60) F7F3MMP2SAE1KDM4E
SCHEMBL724309 0.92 PPARA (0.54) F7F3MMP2SAE1KDM4E
SCHEMBL10831702 0.92 PPARA (0.54) F7F3MMP2SAE1KDM4E
SCHEMBL10831673 0.92 PPARA (0.54) F7F3MMP2SAE1KDM4E
SCHEMBL8733022 0.92 PPARA (0.54) F7F3MMP2SAE1KDM4E
SCHEMBL183977 0.92 PPARA (0.54) F7F3MMP2SAE1KDM4E
SCHEMBL10831730 0.92 PPARA (0.54) F7F3MMP2SAE1KDM4E
SCHEMBL10831934 0.92 PPARA (0.54) F7F3MMP2SAE1KDM4E
SCHEMBL11036940 0.92 PPARA (0.54) F7F3MMP2SAE1KDM4E
SCHEMBL826803 0.92 PPARA (0.54) F7F3MMP2SAE1KDM4E

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
EP-3114254-B1 USE OF N-METHYL-N-ACYLGLUCAMINE AS CORROSION INHIBITOR CLARIANT INT LTD (CH) 2018-01-31 EP disclosed
EP-3114255-B1 CORROSION-INHIBITING COMPOSITIONS CLARIANT INT LTD (CH) 2017-12-06 EP disclosed
EP-3114254-A1 USE OF N-METHYL-N-ACYLGLUCAMINE AS CORROSION INHIBITOR Clariant International Ltd (CH) 2017-01-11 EP disclosed
EP-3114255-A1 CORROSION-INHIBITING COMPOSITIONS Clariant International Ltd (CH) 2017-01-11 EP disclosed
WO-2015131987-A1 CORROSION-INHIBITING COMPOSITIONS CLARIANT INTERNATIONAL LTD (CH) 2015-09-11 WO disclosed