SCHEMBL6506410

SCHEMBL6506410

CN(CC#Cc1ccc(/C=C2/SC(=O)NC2=O)cc1)c1nc2ccccc2o1

nearest known ligand 0.68

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PPARG P37231 6/20 0.47
PIM1 P11309 4/20 0.43
PIM2 Q9P1W9 4/20 0.43
PIM3 Q86V86 1/20 0.43
GSK3B P49841 2/20 0.42
HPGD P15428 2/20 0.40
PTPN1 P18031 1/20 0.40
POLB P06746 1/20 0.40
MAOA P21397 1/20 0.40
MAOB P27338 1/20 0.40
IGF1R P08069 1/20 0.40
KDM4E B2RXH2 1/20 0.39
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 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
SCHEMBL6506413 1.00 PPARG (0.47) PPARGPIM1PIM2PIM3GSK3B
SCHEMBL12520463 0.81 PPARG (0.68) PPARGPIM1PIM2HPGD
SCHEMBL1848738 0.81 PPARG (0.68) PPARGPIM1PIM2HPGD
SCHEMBL1848740 0.81 PPARG (0.68) PPARGPIM1PIM2HPGD
SCHEMBL6514148 0.81 PPARG (0.68) PPARGPIM1PIM2PIM3GSK3B
SCHEMBL1848112 0.80 PPARG (0.61) PPARGPIM1PIM2HPGD
SCHEMBL1848111 0.80 PPARG (0.61) PPARGPIM1PIM2HPGD
SCHEMBL12521873 0.80 PPARG (0.61) PPARGPIM1PIM2HPGD
SCHEMBL12521883 0.79 PPARG (0.61) PPARGPIM1PIM2HPGD
SCHEMBL1851183 0.79 PPARG (0.61) PPARGPIM1PIM2HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005100331-A2 ANTIDIABETIC AGENTS RANBAXY LABORATORIES LIMITED (IN) 2005-10-27 WO disclosed