SCHEMBL7248362

SCHEMBL7248362

CC(C)=C1C(=O)Nc2ccc(-c3cncc(OCC(N)Cc4c[nH]c5ccccc45)c3)cc21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 18/20 1.00
CHEK1 O14757 2/20 0.70
PDPK1 O15530 2/20 0.69
DYRK3 O43781 2/20 0.69
ROCK2 O75116 2/20 0.69
RPS6KA5 O75582 2/20 0.69
PRKD3 O94806 2/20 0.69
MAP4K4 O95819 2/20 0.69
PRKCG P05129 2/20 0.69
CDK1 P06493 2/20 0.69
PHKG2 P15735 2/20 0.69
PRKACA P17612 2/20 0.69
CDK2 P24941 2/20 0.69
MARK3 P27448 2/20 0.69
MAPK1 P28482 2/20 0.69
AXL P30530 2/20 0.69
FLT4 P35916 2/20 0.69
FLT3 P36888 2/20 0.69
MAPKAPK2 P49137 2/20 0.69
GSK3A P49840 2/20 0.69

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
SCHEMBL6850590 1.00 AKT1 (1.00) AKT1CHEK1PDPK1DYRK3ROCK2
SCHEMBL6850583 1.00 AKT1 (1.00) AKT1CHEK1PDPK1DYRK3ROCK2
SCHEMBL6857510 0.90 AKT1 (0.82) AKT1CHEK1PDPK1DYRK3ROCK2
SCHEMBL6851363 0.88 AKT1 (0.81) AKT1CHEK1PDPK1DYRK3ROCK2
SCHEMBL6851376 0.88 AKT1 (0.81) AKT1CHEK1PDPK1DYRK3ROCK2
SCHEMBL6855185 0.87 AKT1 (0.81) AKT1CHEK1PDPK1DYRK3ROCK2
SCHEMBL6855173 0.87 AKT1 (0.81) AKT1CHEK1PDPK1DYRK3ROCK2
SCHEMBL6855160 0.87 AKT1 (0.81) AKT1CHEK1PDPK1DYRK3ROCK2
SCHEMBL6930871 0.87 AKT1 (0.81) AKT1CHEK1PDPK1DYRK3ROCK2
SCHEMBL6853402 0.86 AKT1 (0.75) AKT1CHEK1PDPK1DYRK3ROCK2

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-20030199511-A1 Kinase inhibitors ABBVIE INC. 2003-10-23 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-20030199511-A1 Kinase inhibitors MAP3K20, MAP3K19, MAP3K1 AKT1 119/4885CHEK1 53/4885PDPK1 84/4885

“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.