SCHEMBL3968546

SCHEMBL3968546

CCOC(=O)CCCOc1cc(Oc2ccc(CN(Cc3ccccc3)c3cccc([N+](=O)[O-])c3C)cc2)ccc1Cl

nearest known ligand 0.46

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 18/20 0.46
PGR P06401 3/20 0.44
NR3C2 P08235 3/20 0.44
AR P10275 3/20 0.44
ALDH1A1 P00352 1/20 0.39
MAPK1 P28482 1/20 0.39
KMT2A Q03164 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
CYP2C19 P33261 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL3967169 0.90 NR3C1 (0.57) NR3C1PGRNR3C2ARCYP1A2
SCHEMBL3968072 0.90 NR3C1 (0.50) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL3966308 0.89 NR3C1 (0.56) NR3C1PGRNR3C2AR
SCHEMBL3967607 0.87 NR3C1 (0.55) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL3964376 0.87 LTA4H (0.48) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL3964029 0.86 NR3C1 (0.54) NR3C1PGRNR3C2ARMAPK1
SCHEMBL3963499 0.82 NR3C1 (0.48) NR3C1PGRNR3C2ARALDH1A1
SCHEMBL3965542 0.79 NR3C1 (0.62) NR3C1PGRNR3C2AR
SCHEMBL3965540 0.79 NR3C1 (0.62) NR3C1PGRNR3C2AR
SCHEMBL3972153 0.79 NR3C1 (0.51) NR3C1PGRNR3C2AR

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 1/4885PGR 249/4885NR3C2 3/4885

“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.