SCHEMBL14119271

SCHEMBL14119271

CCn1c(SC)nc2oc(-c3ccc(C4(NC(=O)OC(C)(C)C)CCC4)cc3)c(-c3ccccc3)c2c1=O

nearest known ligand 0.41

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.41
AKT2 P31751 1/20 0.41
KIT P10721 2/20 0.35
PDE2A O00408 4/20 0.34
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
TNK2 Q07912 4/20 0.33
LCK P06239 2/20 0.33
AURKA O14965 1/20 0.33
CKS1B P61024 1/20 0.32
SKP1 P63208 1/20 0.32
SKP2 Q13309 1/20 0.32
APOBEC3A P31941 1/20 0.31
APOBEC3G Q9HC16 1/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
CHEK1 O14757 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
SCHEMBL14118631 0.92 AKT1 (0.40) AKT1AKT2KITPDE2ACNR1
SCHEMBL14119075 0.92 AKT1 (0.40) AKT1AKT2KITPDE2ACNR1
SCHEMBL14119069 0.91 AKT1 (0.41) AKT1AKT2KITPDE2ATNK2
SCHEMBL14119225 0.91 AKT1 (0.40) AKT1AKT2KITPDE2ACNR1
SCHEMBL14118777 0.91 AKT1 (0.40) AKT1AKT2KITPDE2ACNR1
SCHEMBL1902104 0.90 TNK2 (0.35) PDE2ATNK2LCKAURKAAPOBEC3A
SCHEMBL1904512 0.90 AKT1 (0.43) AKT1AKT2KITPDE2ACNR1
SCHEMBL1907097 0.89 AKT1 (0.41) AKT1AKT2KITPDE2ACNR1
SCHEMBL1907722 0.89 AKT1 (0.41) AKT1AKT2KITPDE2ACNR1
SCHEMBL14118911 0.87 AKT1 (0.40) AKT1AKT2KITCNR1CNR2

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-20120309739-A1 AKT / PKB INHIBITORS ALMAC DISCOVERY LIMITED (GB) 2012-12-06 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-20120309739-A1 AKT / PKB INHIBITORS AKT1, AKT2, AKT3 AKT1 1/4885AKT2 2/4885KIT 1541/4885

“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.