SCHEMBL3971618

SCHEMBL3971618

Cc1c(NCc2ccccc2Br)cccc1NS(C)(=O)=O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 14/20 0.57
KEAP1 Q14145 2/20 0.50
NFE2L2 Q16236 1/20 0.50
PGR P06401 1/20 0.45
NR3C2 P08235 1/20 0.45
AR P10275 1/20 0.45
CD38 P28907 1/20 0.45
TP53 P04637 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
MAPK1 P28482 1/20 0.43
HSD17B10 Q99714 1/20 0.43
ALDH1A1 P00352 2/20 0.43
KDM4E B2RXH2 1/20 0.40
RCE1 Q9Y256 1/20 0.40

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
SCHEMBL3967895 0.80 NR3C1 (0.59) NR3C1KEAP1NFE2L2PGRNR3C2
SCHEMBL1335286 0.78 KEAP1 (0.67) NR3C1KEAP1NFE2L2PGRNR3C2
SCHEMBL3972558 0.77 NR3C1 (0.89) NR3C1PGRNR3C2AR
SCHEMBL13869170 0.74 KEAP1 (0.65) NR3C1KEAP1NFE2L2PGRNR3C2
SCHEMBL20362061 0.73 CA12 (0.50) CD38TP53GAAMAPTMAPK1
SCHEMBL29388997 0.73 KEAP1 (0.55) NR3C1KEAP1NFE2L2PGRNR3C2
SCHEMBL1291091 0.73 KEAP1 (0.55) NR3C1KEAP1NFE2L2PGRNR3C2
SCHEMBL3964987 0.73 NR3C1 (1.00) NR3C1PGRNR3C2AR
SCHEMBL7156621 0.72 NR3C1 (0.51) NR3C1KEAP1NFE2L2PGRNR3C2
SCHEMBL21931626 0.70 KEAP1 (0.59) NR3C1KEAP1NFE2L2PGRNR3C2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1363876-B1 GLUCOCORTICOID RECEPTOR MODULATORS KAROBIO AB (SE) 2009-07-29 EP disclosed
EP-1363876-A1 GLUCOCORTICOID RECEPTOR MODULATORS Abbott Laboratories (US) 2003-11-26 EP disclosed
US-6583180-B2 Antidiabetic agents ABBOTT LABORATORIES 2003-06-24 US disclosed
US-20020156311-A1 Glucocorticoid receptor modulators KARO BIO AB (SE) 2002-10-24 US disclosed
WO-2002064550-A1 GLUCOCORTICOID RECEPTOR MODULATORS ABBOTT LABORATORIES (US) 2002-08-22 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20020156311-A1 Glucocorticoid receptor modulators NR3C1, NR5A1, NR3C2 NR3C1 1/4885KEAP1 2044/4885NFE2L2 808/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.