SCHEMBL868648

SCHEMBL868648

CC(C)(C)OC(=O)N1CCC(n2cc(-c3ccc4c(c3)CCN4C(=O)Cc3cc(F)ccc3F)c3c(N)ncnc32)CC1

nearest known ligand 0.69

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EIF2AK3 Q9NZJ5 13/20 0.69
SRC P12931 5/20 0.54
EGFR P00533 3/20 0.53
ABL1 P00519 2/20 0.53
ABL2 P42684 2/20 0.53
EIF2AK2 P19525 1/20 0.52
MEN1 O00255 1/20 0.49

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
SCHEMBL868471 0.90 EIF2AK3 (0.80) EIF2AK3EIF2AK2
SCHEMBL2374504 0.90 EIF2AK3 (0.67) EIF2AK3EIF2AK2
SCHEMBL869781 0.89 EIF2AK3 (0.68) EIF2AK3SRCABL1ABL2EIF2AK2
SCHEMBL868766 0.88 EIF2AK3 (0.74) EIF2AK3EIF2AK2
SCHEMBL869430 0.85 EIF2AK3 (0.68) EIF2AK3SRCEGFRABL1ABL2
SCHEMBL868231 0.85 EIF2AK3 (0.76) EIF2AK3EIF2AK2
SCHEMBL868270 0.85 EIF2AK3 (0.76) EIF2AK3EIF2AK2
SCHEMBL24491376 0.84 RIPK1 (0.73) EIF2AK3SRCEGFRABL1ABL2
SCHEMBL29651856 0.84 RIPK1 (0.73) EIF2AK3SRCEGFRABL1ABL2
SCHEMBL868634 0.82 EIF2AK3 (1.00) EIF2AK3EIF2AK2

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 16/4885SRC 2497/4885EGFR 49/4885
US-20120077828-A1 CHEMICAL COMPOUNDS BRCA1, IRS1, IGF1R EIF2AK3 16/4885SRC 2497/4885EGFR 49/4885

“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.