SCHEMBL4325784

SCHEMBL4325784

CS(=O)(=O)c1ccc(C[C@@H](COc2ccc3c(cnn3-c3ccc(F)cc3)c2)NC(=O)CO)cc1

nearest known ligand 0.68

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 13/20 0.68
SMO Q99835 5/20 0.46
PGR P06401 1/20 0.44
CCR1 P32246 2/20 0.44

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
SCHEMBL4375137 0.83 NR3C1 (0.66) NR3C1SMOPGR
SCHEMBL524419 0.81 NR3C1 (1.00) NR3C1PGR
SCHEMBL524418 0.81 NR3C1 (1.00) NR3C1PGR
SCHEMBL9943289 0.78 NR3C1 (0.52) NR3C1SMOPGR
SCHEMBL12805049 0.77 NR3C1 (0.59) NR3C1SMOPGR
SCHEMBL3814256 0.76 NR3C1 (0.52) NR3C1SMOPGR
SCHEMBL835455 0.74 NR3C1 (0.67) NR3C1PGR
SCHEMBL835456 0.74 NR3C1 (0.67) NR3C1PGR
SCHEMBL12805643 0.74 NR3C1 (0.56) NR3C1SMOPGR
SCHEMBL9943272 0.73 NR3C1 (0.57) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2102169-A1 INDAZOLYL ESTER AND AMIDE DERIVATIVES FOR THE TREATMENT OF GLUCOCORTICOID RECEPTOR MEDIATED DISORDERS AstraZeneca AB (SE) 2009-09-23 EP claimed
WO-2008076048-A1 INDAZOLYL ESTER AND AMIDE DERIVATIVES FOR THE TREATMENT OF GLUCOCORTICOID RECEPTOR MEDIATED DISORDERS ASTRAZENECA AB (SE) 2008-06-26 WO claimed