SCHEMBL15775174

SCHEMBL15775174

CN(NC(=O)CN1c2ccccc2Sc2ccccc21)C(N)=S

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.51
MAPK1 P28482 2/20 0.49
KDM4E B2RXH2 1/20 0.49
MAPT P10636 8/20 0.48
GFER P55789 1/20 0.46
MEN1 O00255 3/20 0.46
KMT2A Q03164 3/20 0.46
LMNA P02545 2/20 0.46
ABCB11 O95342 1/20 0.46
CHRM2 P08172 1/20 0.46
HTR1A P08908 1/20 0.46
ADRA2A P08913 1/20 0.46
CHRM1 P11229 1/20 0.46
DRD1 P21728 1/20 0.46
TBXA2R P21731 1/20 0.46
SLC6A2 P23975 1/20 0.46
SLC6A4 P31645 1/20 0.46
ADRA1A P35348 1/20 0.46
OPRM1 P35372 1/20 0.46
DRD3 P35462 1/20 0.46

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
SCHEMBL15775129 0.83 PPARG (0.47) PPARGMAPK1KDM4EMAPTGFER
SCHEMBL15775291 0.82 PPARG (0.52) PPARGMAPK1KDM4EMAPTGFER
SCHEMBL15775209 0.80 PPARG (0.47) PPARGMAPK1KDM4EMAPTGFER
SCHEMBL3240026 0.76 MAPT (0.58) PPARGMAPK1KDM4EMAPTMEN1
SCHEMBL15775918 0.74 AR (0.46) PPARGMAPK1KDM4EMAPTMEN1
SCHEMBL15775176 0.74 PPARG (0.70) PPARGMAPK1KDM4EMAPTGFER
SCHEMBL8428762 0.74 MAPT (0.63) PPARGMAPK1KDM4EMAPTMEN1
SCHEMBL8428563 0.71 BCHE (0.65) PPARGMAPK1KDM4EMAPTGFER
SCHEMBL9423724 0.71 NOX1 (0.59) MAPTMEN1KMT2ALMNAGAA
SCHEMBL15775131 0.70 PPARG (0.71) PPARGMAPK1KDM4EMAPTGFER

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-2014086478-A1 INHIBITORS OF MALT1 PROTEASE Helmholtz Zentrum München - Deutsches Forschungszentrum für Gesundheit und Umwelt (GmbH) (DE) 2014-06-12 WO disclosed