SCHEMBL8720139

SCHEMBL8720139

CCCc1cc(CCC)c(NS(=O)(=O)O)c(CCC)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR4 Q5NUL3 1/20 0.43
TRPV1 Q8NER1 2/20 0.35
METAP2 P50579 1/20 0.35
MTNR1A P48039 1/20 0.35
CA2 P00918 1/20 0.34
PTPN1 P18031 2/20 0.33
PTPN11 Q06124 2/20 0.33
LMNA P02545 1/20 0.33
HPGD P15428 1/20 0.33
HIF1A Q16665 1/20 0.33
HSD17B10 Q99714 1/20 0.33
PLK1 P53350 1/20 0.33
FLT1 P17948 1/20 0.32
FLT4 P35916 1/20 0.32
KDR P35968 1/20 0.32
ALOX5 P09917 1/20 0.32
CNR1 P21554 1/20 0.32
CNR2 P34972 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRA5 P31644 1/20 0.31

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
SCHEMBL28195816 0.84 FFAR4 (0.59) FFAR4TRPV1METAP2CA2GABRA3
SCHEMBL1952267 0.76 CA2 (0.37) FFAR4MTNR1ACA2PTPN1PTPN11
SCHEMBL3633717 0.72 FLT1 (0.34) FFAR4METAP2MTNR1ACA2PTPN1
SCHEMBL7739121 0.68 CA2 (0.37) FFAR4MTNR1ACA2PTPN1PTPN11
SCHEMBL7739123 0.68 CA2 (0.50) FFAR4CA2PTPN1PTPN11ALOX5
SCHEMBL23679879 0.68 CA2 (0.37) FFAR4MTNR1ACA2PTPN1PTPN11
SCHEMBL11800303 0.68 CNR1 (0.43) FFAR4METAP2MTNR1ACA2LMNA
SCHEMBL7299326 0.68 PTPN1 (0.36) FFAR4MTNR1ACA2PTPN1PTPN11
SCHEMBL6618290 0.68 CA2 (0.59) FFAR4CA2LMNAPLK1CNR1
SCHEMBL1023215 0.68 DHFR (0.45) PTPN1PTPN11HPGDALOX5CNR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0858336-A1 METHOD AND PHARMACEUTICAL COMPOSITION FOR REGULATING LIPID CONCENTRATION WARNER-LAMBERT COMPANY (US) 1998-08-19 EP claimed
WO-1997016184-A1 METHOD AND PHARMACEUTICAL COMPOSITION FOR REGULATING LIPID CONCENTRATION WARNER-LAMBERT COMPANY (US) 1997-05-09 WO claimed