SCHEMBL869247

SCHEMBL869247

CC(C)(C)c1nc(N(C(=O)O)C(=O)O)c2c(-c3ccc4c(c3)CCN4C(=O)Cc3cc(F)ccc3F)c(C(C)(C)C)oc2c1CCNC(=O)OCc1ccccc1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EIF2AK3 Q9NZJ5 12/20 0.39
MAPK1 P28482 1/20 0.33
CYP11B1 P15538 1/20 0.32
CYP11B2 P19099 1/20 0.32
RIPK1 Q13546 3/20 0.32
PIK3CD O00329 1/20 0.31
CYP3A4 P08684 1/20 0.31
PIK3CB P42338 1/20 0.31
EIF2AK1 Q9BQI3 1/20 0.30
RORC P51449 1/20 0.30

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
SCHEMBL869493 0.83 EIF2AK3 (0.47) EIF2AK3MAPK1RIPK1PIK3CDCYP3A4
SCHEMBL14655779 0.78 EIF2AK3 (0.51) EIF2AK3CYP11B1CYP11B2RIPK1EIF2AK1
SCHEMBL869246 0.75 EIF2AK3 (0.48) EIF2AK3CYP11B1CYP11B2RIPK1EIF2AK1
SCHEMBL6926794 0.72 EIF2AK3 (0.60) EIF2AK3RIPK1EIF2AK1
SCHEMBL868753 0.71 EIF2AK3 (0.37) EIF2AK3MAPK1RIPK1CYP3A4EIF2AK1
SCHEMBL14655630 0.64 EIF2AK3 (0.61) EIF2AK3MAPK1CYP11B1CYP11B2PIK3CD
SCHEMBL14655668 0.63 EIF2AK3 (0.60) EIF2AK3MAPK1CYP11B1CYP11B2RIPK1
SCHEMBL868362 0.61 EIF2AK3 (0.63) EIF2AK3RIPK1EIF2AK1
SCHEMBL14576841 0.61 EIF2AK3 (0.67) EIF2AK3RIPK1EIF2AK1
SCHEMBL869492 0.60 EIF2AK3 (0.56) EIF2AK3MAPK1RIPK1EIF2AK1

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-2549868-B1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2015-01-07 EP disclosed
US-8598156-B2 Chemical compounds GLAXOSMITHKLINE LLC (US) 2013-12-03 US disclosed
US-20130018038-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2013-01-17 US disclosed
US-20120077828-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2012-03-29 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 (2 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-20130018038-A1 CHEMICAL COMPOUNDS BRCA1, IRS1, IGF1R EIF2AK3 16/4885MAPK1 5/4885CYP11B1 341/4885
US-20120077828-A1 CHEMICAL COMPOUNDS BRCA1, IRS1, IGF1R EIF2AK3 16/4885MAPK1 5/4885CYP11B1 341/4885

“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.