SCHEMBL4410075

SCHEMBL4410075

CCNCC(O)(CNc1cc(C)cc2c1cnn2-c1ccc(C(=O)OCc2ccccc2)cc1)C(F)(F)F

nearest known ligand 0.61

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 19/20 0.61
MAPT P10636 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45

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
SCHEMBL13884918 0.92 NR3C1 (0.62) NR3C1
SCHEMBL3972292 0.86 NR3C1 (0.53) NR3C1MAPTTDP1L3MBTL1
SCHEMBL476759 0.85 NR3C1 (0.71) NR3C1
SCHEMBL3973080 0.85 NR3C1 (0.68) NR3C1
SCHEMBL3975510 0.84 NR3C1 (0.57) NR3C1
SCHEMBL13884670 0.84 NR3C1 (0.61) NR3C1
SCHEMBL13885528 0.84 NR3C1 (0.59) NR3C1
SCHEMBL13885359 0.83 NR3C1 (0.65) NR3C1
SCHEMBL13884722 0.83 NR3C1 (0.52) NR3C1MAPT
SCHEMBL4407495 0.83 NR3C1 (0.56) NR3C1

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
WO-2009050243-A1 INDAZOLES AS GLUCOCORTICOID RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 WO disclosed
WO-2009050243-A1 INDAZOLES AS GLUCOCORTICOID RECEPTOR LIGANDS GLAXO GROUP LIMITED (GB) 2009-04-23 WO disclosed