SCHEMBL4784906

SCHEMBL4784906

Cc1ccc(C)c(S(=O)(=O)N[C@@H](C)CCc2ccc3c(cnn3-c3cncnc3)c2)c1C

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 15/20 0.49
SMO Q99835 5/20 0.38
PGR P06401 1/20 0.37
CYP3A4 P08684 1/20 0.37
CYP2C9 P11712 1/20 0.37

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
SCHEMBL4736966 0.90 NR3C1 (0.58) NR3C1PGRCYP3A4CYP2C9
SCHEMBL4737912 0.78 NR3C1 (0.72) NR3C1SMOPGRCYP3A4CYP2C9
SCHEMBL4737072 0.75 SMO (0.42) SMO
SCHEMBL4114088 0.74 NR3C1 (0.80) NR3C1PGRCYP3A4CYP2C9
SCHEMBL4738893 0.72 SMO (0.47) NR3C1SMO
SCHEMBL4124674 0.66 NR3C1 (1.00) NR3C1PGRCYP3A4CYP2C9
SCHEMBL4120136 0.64 NR3C1 (1.00) NR3C1PGRCYP3A4CYP2C9
SCHEMBL4108810 0.64 NR3C1 (1.00) NR3C1PGRCYP3A4CYP2C9
SCHEMBL4736970 0.62 NR3C1 (0.53) NR3C1PGR
SCHEMBL4853828 0.61 SMO (0.59) NR3C1SMOPGR

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 claimed