SCHEMBL14005268

SCHEMBL14005268

CC(C)(C)c1cncc(OC[C@@H](N)Cc2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 16/20 0.56
RPS6KB1 P23443 4/20 0.56
PDPK1 O15530 3/20 0.56
PIM1 P11309 3/20 0.56
AKT2 P31751 3/20 0.56
CSNK1D P48730 3/20 0.56
GSK3A P49840 3/20 0.56
GSK3B P49841 3/20 0.56
CDC42BPA Q5VT25 3/20 0.56
CDC7 O00311 2/20 0.56
PLK4 O00444 2/20 0.56
CHEK1 O14757 2/20 0.56
AURKA O14965 2/20 0.56
DCLK1 O15075 2/20 0.56
MAPK13 O15264 2/20 0.56
DAPK3 O43293 2/20 0.56
DYRK3 O43781 2/20 0.56
RPS6KA5 O75582 2/20 0.56
PRKD3 O94806 2/20 0.56
PAK4 O96013 2/20 0.56

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
SCHEMBL14004833 0.85 AKT1 (0.57) AKT1RPS6KB1PDPK1PIM1AKT2
SCHEMBL14004866 0.85 AKT1 (0.57) AKT1RPS6KB1PDPK1PIM1AKT2
SCHEMBL14005208 0.84 AKT1 (0.46) AKT1RPS6KB1PIM1AKT2CSNK1D
SCHEMBL14005271 0.83 AKT1 (0.48) AKT1RPS6KB1PDPK1PIM1AKT2
SCHEMBL14004831 0.83 AKT1 (0.48) AKT1RPS6KB1PDPK1PIM1AKT2
SCHEMBL14005282 0.83 AKT1 (0.47) AKT1RPS6KB1PIM1AKT2CSNK1D
SCHEMBL14004834 0.83 AKT1 (0.59) AKT1RPS6KB1PIM1AKT2CSNK1D
SCHEMBL14004889 0.83 AKT1 (0.59) AKT1RPS6KB1PIM1AKT2CSNK1D
SCHEMBL14004891 0.81 AKT1 (0.56) AKT1RPS6KB1PDPK1PIM1AKT2
SCHEMBL14005202 0.80 AKT1 (0.61) AKT1RPS6KB1PDPK1PIM1AKT2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080293712-A1 Benzo[C][2,7]Naphtyridine Derivatives, Methods of Making Thereof and Methods of Use Thereof WYETH (US) 2008-11-27 US disclosed
US-20080293712-A1 Benzo[C][2,7]Naphtyridine Derivatives, Methods of Making Thereof and Methods of Use Thereof WYETH (US) 2008-11-27 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-20080293712-A1 Benzo[C][2,7]Naphtyridine Derivatives, Methods of Making Thereof and Methods of Use Thereof PDPK1, PDK2, PDK3 AKT1 157/4885RPS6KB1 250/4885PDPK1 1/4885

“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.