SCHEMBL758076

SCHEMBL758076

Nc1ccc2c(c1)OC(c1ccccc1)C(=O)N2c1ccc(F)cc1

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C2 P08235 2/20 0.66
GSK3B P49841 4/20 0.39
ADK P55263 3/20 0.39
KMT2A Q03164 1/20 0.38
ALDH1A1 P00352 1/20 0.38
CACNA1B Q00975 1/20 0.36
APBA1 Q02410 1/20 0.36
FADS1 O60427 1/20 0.36
MAPT P10636 1/20 0.36
NR3C1 P04150 1/20 0.36
ADCY2 Q08462 2/20 0.36
CHEK1 O14757 1/20 0.35
AURKA O14965 1/20 0.35
DAPK3 O43293 1/20 0.35
JAK2 O60674 1/20 0.35
PRKD3 O94806 1/20 0.35
MAP4K4 O95819 1/20 0.35
PAK4 O96013 1/20 0.35
ABL1 P00519 1/20 0.35
NTRK1 P04629 1/20 0.35

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
SCHEMBL757581 0.82 NR3C2 (0.61) NR3C2GSK3BADKKMT2AALDH1A1
Hydrochloric Acid SCHEMBL756901 0.80 NR3C2 (0.46) NR3C2ALDH1A1CACNA1BAPBA1FADS1
SCHEMBL754339 0.79 NR3C2 (1.00) NR3C2NR3C1
SCHEMBL17434194 0.74 F10 (0.45) NR3C2GSK3BADKKMT2ANR3C1
SCHEMBL756162 0.71 NR3C2 (0.46) NR3C2ALDH1A1CACNA1BAPBA1MAPT
SCHEMBL754931 0.70 NR3C2 (0.86) NR3C2NR3C1
SCHEMBL755966 0.69 TNKS (0.45) GSK3BCHEK1AURKADAPK3JAK2
SCHEMBL756843 0.69 NR3C2 (0.63) NR3C2ALDH1A1CACNA1BAPBA1MAPT
SCHEMBL754974 0.68 NR3C2 (0.81) NR3C2NR3C1
SCHEMBL2265291 0.68 GSK3B (0.52) GSK3BADKKMT2AALDH1A1MAPT

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
US-8188073-B2 Benzoxazines and related nitrogen-containing heterobicyclic compounds useful as mineralocorticoid receptor modulating agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2012-05-29 US disclosed
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
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
US-20090023716-A1 Benzoxazines and Related Nitrogen-Containing Heterobicyclic Compounds Useful as Mineralocorticoid Receptor Modulating Agents MITSUBISHI TANABE PHARMA CORPORATION (JP) 2009-01-22 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-20090023716-A1 Benzoxazines and Related Nitrogen-Containing Heterobicyclic Compounds Useful as Mineralocorticoid Receptor Modulating Agents NR3C2, MC2R, NR3C1 NR3C2 1/4885GSK3B 2586/4885ADK 2774/4885

“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.