SCHEMBL1314933

SCHEMBL1314933

COc1ccc([N+](=O)[O-])cc1OCc1c(-c2ccc(OC(=O)Oc3ccc(Cl)cc3)cc2OC)ccc2c1C(C)=CC(C)(C)N2

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PGR P06401 10/20 0.41
NR3C1 P04150 5/20 0.39
MEN1 O00255 4/20 0.39
KMT2A Q03164 4/20 0.39
AR P10275 3/20 0.39
NR3C2 P08235 2/20 0.39
NPC1 O15118 1/20 0.39
MAPT P10636 5/20 0.34
LMNA P02545 3/20 0.34
HTT P42858 3/20 0.34
KDM4E B2RXH2 2/20 0.34
TP53 P04637 2/20 0.34
G6PD P11413 1/20 0.34
GFER P55789 1/20 0.34
HSD17B10 Q99714 1/20 0.34
MAPK1 P28482 1/20 0.34
DRD4 P21917 1/20 0.34
ALDH1A1 P00352 2/20 0.34
GAA P10253 1/20 0.34
NPSR1 Q6W5P4 2/20 0.34

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
SCHEMBL1314820 0.93 PGR (0.40) PGRNR3C1MEN1KMT2AAR
SCHEMBL1314309 0.92 PGR (0.43) PGRNR3C1MEN1KMT2AAR
SCHEMBL5040844 0.90 PGR (0.48) PGRNR3C1ARNR3C2NPC1
SCHEMBL14847583 0.88 PGR (0.48) PGRNR3C1MEN1KMT2AAR
SCHEMBL1316638 0.88 PGR (0.42) PGRNR3C1MEN1KMT2AAR
SCHEMBL1314037 0.88 MAPT (0.41) PGRNR3C1MEN1KMT2AAR
SCHEMBL1315401 0.87 PGR (0.43) PGRNR3C1MEN1KMT2AAR
SCHEMBL1315676 0.87 PGR (0.42) PGRNR3C1MEN1KMT2AAR
SCHEMBL1314701 0.87 PGR (0.39) PGRNR3C1MEN1KMT2AAR
SCHEMBL2394238 0.87 PGR (0.46) PGRNR3C1ARNR3C2NPC1

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 21 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2319835-B1 GLUCOCORTICOID RECEPTOR AGONIST COMPOSED OF 2,2,4-TRIMETHYL-6-PHENYL-1,2-DIHYDROQUINOLINE DERIVATIVE HAVING SUBSTITUTED OXY GROUP AYUMI PHARMACEUTICAL CORP (JP) 2016-04-13 EP disclosed
US-8440660-B2 Method for treating a disease related to the glucocorticoid receptor SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-05-14 US disclosed
US-8440660-B2 Method for treating a disease related to the glucocorticoid receptor SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-05-14 US disclosed
US-8440660-B2 Method for treating a disease related to the glucocorticoid receptor SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-05-14 US disclosed
US-8426406-B2 Glucocorticoid receptor agonist comprising 2,2,4-trimethyl-6-phenyl-1,2-dihydroquinoline derivatives having substituted oxy group SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-04-23 US disclosed
US-8426406-B2 Glucocorticoid receptor agonist comprising 2,2,4-trimethyl-6-phenyl-1,2-dihydroquinoline derivatives having substituted oxy group SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-04-23 US disclosed
US-8426406-B2 Glucocorticoid receptor agonist comprising 2,2,4-trimethyl-6-phenyl-1,2-dihydroquinoline derivatives having substituted oxy group SANTEN PHARMACEUTICAL CO., LTD. (JP) 2013-04-23 US disclosed
US-20110275620-A1 Method for preventing or treating a disease related to the glucocorticoid receptor SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-11-10 US disclosed
US-20110275620-A1 Method for preventing or treating a disease related to the glucocorticoid receptor SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-11-10 US disclosed
US-20110275620-A1 Method for preventing or treating a disease related to the glucocorticoid receptor SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-11-10 US disclosed
US-8008496-B2 1,2-dihydroquinoline derivative having substituted phenylchalcogeno lower alkyl group and ester-introduced phenyl group as substituents SANTEN PHARMACEUTICAL CO., LTD. (JP) 2011-08-30 US disclosed
US-20110118260-A1 GLUCOCORTICOID RECEPTOR AGONIST COMPRISING 2,2,4-TRIMETHYL-6-PHENYL-1,2-DIHYDROQUINOLINE DERIVATIVES HAVING SUBSTITUTED OXY GROUP SANTEN PHARMACEUTICAL CO.,LTD. (JP) 2011-05-19 US disclosed
US-20110118260-A1 GLUCOCORTICOID RECEPTOR AGONIST COMPRISING 2,2,4-TRIMETHYL-6-PHENYL-1,2-DIHYDROQUINOLINE DERIVATIVES HAVING SUBSTITUTED OXY GROUP SANTEN PHARMACEUTICAL CO.,LTD. (JP) 2011-05-19 US disclosed
US-20110118260-A1 GLUCOCORTICOID RECEPTOR AGONIST COMPRISING 2,2,4-TRIMETHYL-6-PHENYL-1,2-DIHYDROQUINOLINE DERIVATIVES HAVING SUBSTITUTED OXY GROUP SANTEN PHARMACEUTICAL CO.,LTD. (JP) 2011-05-19 US disclosed
EP-2319835-A1 GLUCOCORTICOID RECEPTOR AGONIST COMPOSED OF 2,2,4-TRIMETHYL-6-PHENYL-1,2-DIHYDROQUINOLINE DERIVATIVE HAVING SUBSTITUTED OXY GROUP Santen Pharmaceutical Co., Ltd (JP) 2011-05-11 EP disclosed
EP-2319835-A1 GLUCOCORTICOID RECEPTOR AGONIST COMPOSED OF 2,2,4-TRIMETHYL-6-PHENYL-1,2-DIHYDROQUINOLINE DERIVATIVE HAVING SUBSTITUTED OXY GROUP Santen Pharmaceutical Co., Ltd (JP) 2011-05-11 EP disclosed
US-20100056504-A1 NOVEL 1,2-DIHYDROQUINOLINE DERIVATIVE HAVING SUBSTITUTED PHENYLCHALCOGENO LOWER ALKYL GROUP AND ESTER- INTRODUCED PHENYL GROUP AS SUBSTITUENTS AYUMI PHARMACEUTICAL CORPORATION (JP) 2010-03-04 US disclosed
US-20100056504-A1 NOVEL 1,2-DIHYDROQUINOLINE DERIVATIVE HAVING SUBSTITUTED PHENYLCHALCOGENO LOWER ALKYL GROUP AND ESTER- INTRODUCED PHENYL GROUP AS SUBSTITUENTS AYUMI PHARMACEUTICAL CORPORATION (JP) 2010-03-04 US disclosed
WO-2009139361-A1 GLUCOCORTICOID RECEPTOR AGONIST COMPOSED OF 2,2,4-TRIMETHYL-6-PHENYL-1,2-DIHYDROQUINOLINE DERIVATIVE HAVING SUBSTITUTED OXY GROUP 参天製薬株式会社 (JP) 2009-11-19 WO disclosed
EP-2085387-A1 NOVEL 1,2-DIHYDROQUINOLINE DERIVATIVE HAVING SUBSTITUTED PHENYLCHALCOGENO LOWER ALKYL GROUP AND ESTER-INTRODUCED PHENYL GROUP AS SUBSTITUENTS Santen Pharmaceutical Co., Ltd (JP) 2009-08-05 EP 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 (3 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-20100056504-A1 NOVEL 1,2-DIHYDROQUINOLINE DERIVATIVE HAVING SUBSTITUTED PHENYLCHALCOGENO LOWER ALKYL GROUP AND ESTER- INTRODUCED PHENYL GROUP AS SUBSTITUENTS NR3C1, NR3C2, NR5A1 PGR 54/4885NR3C1 1/4885MEN1 3978/4885
US-20110118260-A1 GLUCOCORTICOID RECEPTOR AGONIST COMPRISING 2,2,4-TRIMETHYL-6-PHENYL-1,2-DIHYDROQUINOLINE DERIVATIVES HAVING SUBSTITUTED OXY GROUP NR3C1, NR3C2, MC2R PGR 109/4885NR3C1 1/4885MEN1 3197/4885
US-20110275620-A1 Method for preventing or treating a disease related to the glucocorticoid receptor NR3C1, NR3C2, NR5A1 PGR 183/4885NR3C1 1/4885MEN1 2278/4885

“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.