SCHEMBL756434

SCHEMBL756434

CC1(C)Oc2cc(NS(C)(=O)=O)ccc2N(c2ncccc2F)C1=O

nearest known ligand 0.64

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 6/20 0.64
MET P08581 1/20 0.38
ADRA1D P25100 2/20 0.37
ADRA1A P35348 1/20 0.37
SCN9A Q15858 1/20 0.37
BRD4 O60885 5/20 0.36
CDK8 P49336 1/20 0.36

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
SCHEMBL755328 0.84 NR3C2 (0.65) NR3C2METSCN9ABRD4
SCHEMBL758490 0.81 NR3C2 (0.58) NR3C2ADRA1DADRA1ASCN9ABRD4
SCHEMBL756151 0.81 NR3C2 (0.66) NR3C2SCN9ABRD4
SCHEMBL756637 0.80 NR3C2 (0.78) NR3C2SCN9ABRD4
SCHEMBL754177 0.80 NR3C2 (0.74) NR3C2BRD4
SCHEMBL753700 0.79 NR3C2 (0.69) NR3C2ADRA1ASCN9ABRD4
SCHEMBL755857 0.79 NR3C2 (0.80) NR3C2ADRA1ASCN9ABRD4
Mt-3995 SCHEMBL753911 0.78 NR3C2 (1.00) NR3C2BRD4
SCHEMBL756145 0.78 NR3C2 (0.72) NR3C2SCN9ABRD4
SCHEMBL753806 0.78 NR3C2 (0.79) NR3C2BRD4

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-1984345-B9 BENZOXAZINES AND RELATED NITROGEN-CONTAINING HETEROBICYCLIC COMPOUNDS USEFUL AS MINERALOCORTICOID RECEPTOR MODULATING AGENTS MITSUBISHI TANABE PHARMA CORP (JP) 2012-03-21 EP claimed
EP-1984345-B1 BENZOXAZINES AND RELATED NITROGEN-CONTAINING HETEROBICYCLIC COMPOUNDS USEFUL AS MINERALOCORTICOID RECEPTOR MODULATING AGENTS MITSUBISHI TANABE PHARMA CORP (JP) 2011-08-31 EP claimed