SCHEMBL1902109

SCHEMBL1902109

Cn1c(N2CC[C@H](O)C2)nc2oc(-c3ccc(C4(NC(=O)OC(C)(C)C)CCC4)cc3)c(-c3ccccc3)c2c1=O

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.40
AKT2 P31751 1/20 0.40
AURKA O14965 1/20 0.39
DPP4 P27487 2/20 0.35
CKS1B P61024 2/20 0.35
SKP1 P63208 2/20 0.35
SKP2 Q13309 2/20 0.35
CNR1 P21554 2/20 0.34
CNR2 P34972 2/20 0.34
PTPN11 Q06124 2/20 0.34
KIT P10721 1/20 0.34
LCK P06239 1/20 0.33
TNK2 Q07912 1/20 0.33
ACACB O00763 1/20 0.33
ACACA Q13085 1/20 0.33
AADAT Q8N5Z0 1/20 0.33
BRD4 O60885 3/20 0.32
EGFR P00533 1/20 0.32
DGAT1 O75907 1/20 0.32

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
SCHEMBL14120104 1.00 AKT1 (0.40) AKT1AKT2AURKADPP4CKS1B
SCHEMBL1902107 1.00 AKT1 (0.40) AKT1AKT2AURKADPP4CKS1B
SCHEMBL14119006 0.96 AURKA (0.42) AKT1AKT2AURKADPP4CKS1B
SCHEMBL1905473 0.94 AKT1 (0.41) AKT1AKT2AURKADPP4CKS1B
SCHEMBL14119477 0.91 AKT1 (0.42) AKT1AKT2DPP4CKS1BSKP1
SCHEMBL1904499 0.91 AURKA (0.42) AURKAPTPN11LCKTNK2AADAT
SCHEMBL14118683 0.86 AKT1 (0.39) AKT1AKT2DPP4CKS1BSKP1
SCHEMBL1905949 0.86 AURKA (0.46) AURKAPTPN11LCKTNK2AADAT
SCHEMBL14118561 0.85 AKT1 (0.44) AKT1AKT2AURKACNR1CNR2
SCHEMBL1904033 0.85 AURKA (0.37) AURKAPTPN11TNK2EGFR

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 3 patents. 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
EP-2496566-A1 AKT / PKB INHIBITORS Almac Discovery Limited (GB) 2012-09-12 EP disclosed
WO-2011055115-A1 AKT / PKB INHIBITORS ALMAC DISCOVERY LIMITED (GB) 2011-05-12 WO 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 2/4885AURKA 527/4885

“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.