SCHEMBL755189

SCHEMBL755189

CC1(C)Oc2cc(NS(C)(=O)=O)c(Cl)cc2N(c2ccc(F)cc2)C1=O

nearest known ligand 0.70

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 6/20 0.70
PPOX P50336 1/20 0.36
BRD4 O60885 3/20 0.36
PIK3CD O00329 6/20 0.35
PIK3R1 P27986 5/20 0.35
MTOR P42345 5/20 0.35
AR P10275 1/20 0.34
CACNA1B Q00975 1/20 0.33
APBA1 Q02410 1/20 0.33
LRRK2 Q5S007 1/20 0.33

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
SCHEMBL754239 0.88 NR3C2 (0.71) NR3C2BRD4PIK3CDPIK3R1MTOR
SCHEMBL755350 0.87 NR3C2 (0.70) NR3C2BRD4PIK3CDPIK3R1MTOR
SCHEMBL761147 0.87 NR3C2 (0.70) NR3C2BRD4PIK3CDPIK3R1MTOR
SCHEMBL2266367 0.85 NR3C2 (0.67) NR3C2BRD4PIK3CDPIK3R1MTOR
SCHEMBL4530965 0.84 NR3C2 (0.65) NR3C2BRD4
SCHEMBL5088338 0.83 NR3C2 (0.67) NR3C2BRD4PIK3CDPIK3R1MTOR
Mt-3995 SCHEMBL753911 0.82 NR3C2 (1.00) NR3C2BRD4AR
SCHEMBL2267353 0.80 NR3C2 (0.56) NR3C2PIK3CDARCACNA1BAPBA1
SCHEMBL4979414 0.80 NR3C2 (0.71) NR3C2BRD4ARCACNA1BAPBA1
SCHEMBL754848 0.79 NR3C2 (0.59) NR3C2BRD4ARCACNA1BAPBA1

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 3 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
US-7998956-B2 Benzoxazines and related nitrogen-containing heterobicyclic compounds useful as mineralocorticoid receptor modulating agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2011-08-16 US claimed