SCHEMBL4735199

SCHEMBL4735199

C[C@@H](/C=C/c1ccc2c(cnn2-c2cncnc2)c1)NC(=O)OC(C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 17/20 0.40
PGR P06401 3/20 0.39
CYP11B1 P15538 2/20 0.38
CYP11B2 P19099 2/20 0.38
SMO Q99835 1/20 0.38

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
SCHEMBL4738893 0.77 SMO (0.47) NR3C1SMO
SCHEMBL4735202 0.72 DYRK1A (0.45)
SCHEMBL10980321 0.68 PPARA (0.47)
SCHEMBL9058208 0.68 PPARA (0.47)
SCHEMBL10973888 0.68 PPARA (0.47)
SCHEMBL9059145 0.67 PPARA (0.47)
SCHEMBL4784046 0.65 SMO (0.57) NR3C1PGRSMO
SCHEMBL4125598 0.64 NR3C1 (0.42) NR3C1PGRCYP11B1CYP11B2
SCHEMBL4125595 0.64 NR3C1 (0.42) NR3C1PGRCYP11B1CYP11B2
SCHEMBL30964022 0.64 ESR1 (0.47)

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-2008079073-A1 INDAZOLYL SULPHONAMIDE DERIVATIVES FOR THE TREATMENT OF GLUCOCORTICOID RECEPTOR MEDIATED DISORDERS ASTRAZENECA AB (SE) 2008-07-03 WO disclosed