SCHEMBL869013

SCHEMBL869013

Cc1cc(C)n(CC(=O)N2CCc3c2ccc(-c2cn(C)c4ncnc(N)c24)c3F)n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EIF2AK3 Q9NZJ5 20/20 1.00
CYP3A4 P08684 3/20 1.00
EIF2AK2 P19525 3/20 1.00
EIF2AK1 Q9BQI3 3/20 1.00
RIPK1 Q13546 4/20 0.69
CYP2C9 P11712 2/20 0.69
EIF2AK4 Q9P2K8 2/20 0.69
CYP2C8 P10632 1/20 0.62
CYP2D6 P10635 1/20 0.62

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
SCHEMBL29911532 0.90 EIF2AK3 (0.81) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1
SCHEMBL23060137 0.90 EIF2AK3 (0.81) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1
SCHEMBL21237498 0.86 EIF2AK3 (0.76) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1
SCHEMBL869278 0.84 EIF2AK3 (1.00) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1
SCHEMBL23042872 0.82 EIF2AK3 (0.70) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1
SCHEMBL869403 0.82 EIF2AK3 (0.75) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1
SCHEMBL870782 0.82 EIF2AK3 (1.00) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1
SCHEMBL868275 0.81 EIF2AK3 (0.77) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1
SCHEMBL868281 0.81 EIF2AK3 (0.74) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1
SCHEMBL868058 0.80 EIF2AK3 (0.74) EIF2AK3CYP3A4EIF2AK2EIF2AK1RIPK1

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 19 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2549868-B1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2015-01-07 EP claimed
US-20140227289-A1 COMPOUNDS AND METHODS FOR TREATING INSULIN RESISTANCE SYNDROME AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2014-08-14 US claimed
US-8598156-B2 Chemical compounds GLAXOSMITHKLINE LLC (US) 2013-12-03 US claimed
US-20130018038-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2013-01-17 US claimed
WO-2012158123-A1 COMPOUNDS AND METHODS FOR TREATING INSULIN RESISTANCE SYNDROME AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2012-11-22 WO claimed
US-20220348584-A1 PERK INHIBITING INDOLINYL COMPOUNDS HIBERCELL, INC. 2022-11-03 US disclosed
WO-2021041976-A1 PERK INHIBITING INDOLINYL COMPOUNDS HIBERCELL, INC. (US) 2021-03-04 WO disclosed
EP-2549868-B1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2015-01-07 EP disclosed
EP-2549868-B1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2015-01-07 EP disclosed
US-20140227289-A1 COMPOUNDS AND METHODS FOR TREATING INSULIN RESISTANCE SYNDROME AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2014-08-14 US disclosed
US-8598156-B2 Chemical compounds GLAXOSMITHKLINE LLC (US) 2013-12-03 US disclosed
EP-2549868-A1 CHEMICAL COMPOUNDS GlaxoSmithKline LLC (US) 2013-01-30 EP disclosed
US-20130018038-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2013-01-17 US disclosed
US-20130018038-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2013-01-17 US disclosed
WO-2012158123-A1 COMPOUNDS AND METHODS FOR TREATING INSULIN RESISTANCE SYNDROME AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) 2012-11-22 WO disclosed
US-20120077828-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2012-03-29 US disclosed
US-20120077828-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC 2012-03-29 US disclosed
WO-2011119663-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-09-29 WO disclosed
WO-2011119663-A1 CHEMICAL COMPOUNDS GLAXOSMITHKLINE LLC (US) 2011-09-29 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 (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-20130018038-A1 CHEMICAL COMPOUNDS BRCA1, IRS1, IGF1R EIF2AK3 16/4885CYP3A4 1750/4885EIF2AK2 174/4885
US-20120077828-A1 CHEMICAL COMPOUNDS BRCA1, IRS1, IGF1R EIF2AK3 16/4885CYP3A4 1750/4885EIF2AK2 174/4885
US-20220348584-A1 PERK INHIBITING INDOLINYL COMPOUNDS ATF4, MAP3K10, EEF2K EIF2AK3 85/4885CYP3A4 3828/4885EIF2AK2 31/4885

“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.