SCHEMBL757652

SCHEMBL757652

CC(C)(C)CS(=O)(=O)N(Cc1ccc2c(c1)OC(C)(C)C(=O)N2c1ccc(F)cc1)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 6/20 0.50
HIF1A Q16665 2/20 0.32
EPAS1 Q99814 2/20 0.32
POLB P06746 1/20 0.32
SLC9A1 P19634 1/20 0.32
HTR2A P28223 1/20 0.32
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
AR P10275 1/20 0.31
F2 P00734 1/20 0.31
F10 P00742 1/20 0.31
ITGB3 P05106 1/20 0.31
ITGA2B P08514 1/20 0.31
ALKBH5 Q6P6C2 1/20 0.31

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
SCHEMBL4522232 0.90 NR3C2 (0.59) NR3C2HIF1AEPAS1HTR2AMEN1
SCHEMBL757651 0.83 NR3C2 (0.52) NR3C2MEN1KMT2A
SCHEMBL18373035 0.79 NR3C2 (0.62) NR3C2HIF1AEPAS1SLC9A1MEN1
SCHEMBL758124 0.75 BRD4 (0.42) POLB
SCHEMBL2269447 0.74 NR3C2 (0.69) NR3C2POLBAR
SCHEMBL756843 0.70 NR3C2 (0.63) NR3C2SLC9A1AR
SCHEMBL16774522 0.69 NR3C2 (0.65) NR3C2SLC9A1AR
SCHEMBL753047 0.69 NR3C2 (0.47) NR3C2SLC9A1MEN1KMT2AAR
SCHEMBL16978177 0.69 NR3C2 (0.65) NR3C2POLBSLC9A1MEN1KMT2A
SCHEMBL754848 0.69 NR3C2 (0.59) NR3C2AR

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 4 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 disclosed
US-20110251185-A1 BENZOXAZINES AND RELATED NITROGEN-CONTAINING HETEROBICYCLIC COMPOUNDS USEFUL AS MINERALOCORTICOID RECEPTOR MODULATING AGENTS IIJIMA TORU 2011-10-13 US disclosed
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 disclosed
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 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-20110251185-A1 BENZOXAZINES AND RELATED NITROGEN-CONTAINING HETEROBICYCLIC COMPOUNDS USEFUL AS MINERALOCORTICOID RECEPTOR MODULATING AGENTS NR3C2, MC2R, NR3C1 NR3C2 1/4885HIF1A 1399/4885EPAS1 792/4885

“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.