SCHEMBL6700182

SCHEMBL6700182

Cc1ccc(NC(=O)Nc2ncc(C(=O)Nc3nc(C(=O)O)c[nH]3)s2)c(C(=O)C2CCCC2)c1

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LCK P06239 8/20 0.40
MAPK14 Q16539 5/20 0.35
MAPK13 O15264 1/20 0.35
EGFR P00533 1/20 0.35
FYN P06241 1/20 0.35
HCK P08631 1/20 0.35
SRC P12931 1/20 0.35
JAK3 P52333 1/20 0.35
MAPK12 P53778 1/20 0.35
MAPK11 Q15759 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
ABCC1 P33527 1/20 0.34
CCNE1 P24864 2/20 0.33
CDK2 P24941 2/20 0.33
CDK5 Q00535 2/20 0.33
GAA P10253 1/20 0.32
KMT2A Q03164 1/20 0.32
USP2 O75604 1/20 0.32
STAT3 P40763 1/20 0.31

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
SCHEMBL1343126 0.86 SMN1; SMN2 (0.34) MAPK14MAPK13SMN1; SMN2ABCC1CCNE1
SCHEMBL1342828 0.85 SMN1; SMN2 (0.43) LCKMAPK14MAPK13EGFRFYN
SCHEMBL1343766 0.84 LCK (0.40) LCKMAPK14MAPK13EGFRFYN
SCHEMBL1344405 0.83 LCK (0.39) LCKMAPK14MAPK13EGFRFYN
SCHEMBL1342321 0.83 LCK (0.42) LCKMAPK14MAPK13EGFRFYN
SCHEMBL1342258 0.83 LCK (0.45) LCKMAPK14MAPK13EGFRFYN
SCHEMBL1343084 0.83 LCK (0.42) LCKMAPK14MAPK13EGFRFYN
SCHEMBL1341254 0.82 SMN1; SMN2 (0.34) JAK3SMN1; SMN2ABCC1CCNE1CDK2
SCHEMBL1340916 0.82 SMN1; SMN2 (0.39) MAPK14MAPK13SMN1; SMN2ABCC1GAA
SCHEMBL6695568 0.82 POLB (0.40) LCKKMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents VTV THERAPEUTICS LLC 2004-06-24 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-20040122235-A1 Aryl carbonyl derivatives as therapeutic agents GCK, GCKR, PDK2 LCK 1793/4885MAPK14 1028/4885MAPK13 687/4885

“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.