SCHEMBL6744024

SCHEMBL6744024

CCOC(=O)CCc1cc2c([nH]1)CCNC2=O

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.40
GAA P10253 1/20 0.40
RIPK2 O43353 1/20 0.39
RIPK1 Q13546 1/20 0.39
RIPK3 Q9Y572 1/20 0.39
CHEK2 O96017 2/20 0.39
AURKA O14965 2/20 0.39
CDC7 O00311 4/20 0.39
PIM1 P11309 3/20 0.39
PLK4 O00444 2/20 0.39
DAPK3 O43293 2/20 0.39
DYRK3 O43781 2/20 0.39
PRKD3 O94806 2/20 0.39
RPS6KB1 P23443 2/20 0.39
CDK2 P24941 2/20 0.39
MAPK1 P28482 2/20 0.39
CLK2 P49760 2/20 0.39
GSK3B P49841 2/20 0.39
CDK5 Q00535 2/20 0.39
DYRK1A Q13627 2/20 0.39

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
SCHEMBL6746991 0.93 BRD4 (0.39) ALDH1A1GAARIPK2RIPK1RIPK3
SCHEMBL6223604 0.81 CDC7 (0.43) CHEK2CDC7PLK4DAPK3DYRK3
SCHEMBL6223274 0.76 CDC7 (0.42) CHEK2CDC7PLK4DAPK3DYRK3
SCHEMBL31607736 0.76 PLK4 (0.49) ALDH1A1GAARIPK2RIPK1RIPK3
SCHEMBL15243650 0.68 CDC7 (0.53) CHEK2CDC7PIM1PLK4DAPK3
SCHEMBL7753365 0.67 BRD4 (0.61)
SCHEMBL31039276 0.66 CYP4F2 (0.50) ALDH1A1GAAGSK3BCLK4PRKACA
SCHEMBL15870703 0.65 CYP4F2 (0.51) ALDH1A1GAASMN1; SMN2CYP4F2CYP4A11
SCHEMBL25249839 0.64 GPR84 (0.51) ALDH1A1GAASMN1; SMN2CYP4F2CYP4A11
SCHEMBL12598336 0.64 MAPT (0.58) ALDH1A1GAASMN1; SMN2CYP4F2CYP4A11

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-20040209897-A1 Mitogen activated protein kinase-activated protein kinase-2 inhibiting compounds PHARMACIA CORPORATION 2004-10-21 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-20040209897-A1 Mitogen activated protein kinase-activated protein kinase-2 inhibiting compounds MAPKAPK2, MAP3K2, MKNK2 ALDH1A1 4638/4885GAA 1556/4885RIPK2 226/4885

“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.