SCHEMBL869108

SCHEMBL869108

Cn1cc(-c2ccc3c(c2F)CCN3)c2c(N)ncnc21

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EIF2AK3 Q9NZJ5 20/20 0.49
CYP3A4 P08684 3/20 0.49
EIF2AK2 P19525 3/20 0.49
EIF2AK1 Q9BQI3 3/20 0.49
CYP2C9 P11712 2/20 0.49
RIPK1 Q13546 2/20 0.49
EIF2AK4 Q9P2K8 2/20 0.49
CYP2C8 P10632 1/20 0.47
CYP2D6 P10635 1/20 0.47

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
SCHEMBL29911812 1.00 EIF2AK3 (0.49) EIF2AK3CYP3A4EIF2AK2EIF2AK1CYP2C9
Hydrochloric Acid SCHEMBL23042914 0.99 EIF2AK3 (0.48) EIF2AK3CYP3A4EIF2AK2EIF2AK1CYP2C9
Hydrochloric Acid SCHEMBL868686 0.99 EIF2AK3 (0.48) EIF2AK3CYP3A4EIF2AK2EIF2AK1CYP2C9
SCHEMBL27889174 0.87 EIF2AK3 (0.40) EIF2AK3CYP3A4EIF2AK2EIF2AK1CYP2C9
SCHEMBL30120830 0.86 KDR (0.49) EIF2AK3
SCHEMBL24650622 0.86 KDR (0.49) EIF2AK3
Hydrochloric Acid SCHEMBL868325 0.86 EIF2AK3 (0.39) EIF2AK3CYP3A4EIF2AK2EIF2AK1CYP2C9
SCHEMBL23059970 0.84 EIF2AK3 (0.37) EIF2AK3CYP3A4EIF2AK2EIF2AK1CYP2C9
SCHEMBL24650662 0.84 SRC (0.48) EIF2AK3CYP3A4EIF2AK2EIF2AK1CYP2C9
SCHEMBL24651180 0.84 AXL (0.43) EIF2AK3CYP3A4EIF2AK2EIF2AK1CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220348584-A1 PERK INHIBITING INDOLINYL COMPOUNDS HIBERCELL, INC. 2022-11-03 US disclosed
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
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
CN-102917588-B Chemical compounds GLAXOSMITHKLINE LLC (US) 2014-10-08 CN disclosed
US-8598156-B2 Chemical compounds GLAXOSMITHKLINE LLC (US) 2013-12-03 US disclosed
CN-102917588-A Chemical compounds GLAXOSMITHKLINE LLC 2013-02-06 CN 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 (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.