SCHEMBL5067678

SCHEMBL5067678

CCn1c(-c2nonc2NC(=O)OC(C)(C)C)nc2c(-c3ccccc3)ncc(C(=O)O)c21

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RPS6KA5 O75582 3/20 0.47
AKT1 P31749 1/20 0.47
RPS6KA1 Q15418 1/20 0.47
SMN1; SMN2 Q16637 5/20 0.43
MAPT P10636 4/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
TP53 P04637 2/20 0.40
LMNA P02545 3/20 0.40
KDM4E B2RXH2 6/20 0.39
HTT P42858 5/20 0.39
HPGD P15428 5/20 0.39
NPSR1 Q6W5P4 2/20 0.39
GAA P10253 1/20 0.39
CKS1B P61024 3/20 0.39
SKP1 P63208 3/20 0.39
SKP2 Q13309 3/20 0.39
ALDH1A1 P00352 5/20 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
SCHEMBL4069078 0.94 RPS6KA5 (0.46) RPS6KA5AKT1RPS6KA1SMN1; SMN2MAPT
SCHEMBL14031568 0.91 RPS6KA5 (0.47) RPS6KA5AKT1RPS6KA1SMN1; SMN2MAPT
SCHEMBL4070921 0.87 SMN1; SMN2 (0.39) RPS6KA5AKT1RPS6KA1SMN1; SMN2MAPT
SCHEMBL5058547 0.84 CKS1B (0.50) RPS6KA5AKT1RPS6KA1SMN1; SMN2MAPT
SCHEMBL5597414 0.82 TP53 (0.41) TP53KDM4EHTTCKS1BSKP1
SCHEMBL14031474 0.82 AKT1 (0.45) RPS6KA5AKT1RPS6KA1SMN1; SMN2MAPT
SCHEMBL4064408 0.80 RPS6KA5 (0.66) RPS6KA5AKT1RPS6KA1KDM4ESLC2A1
SCHEMBL4389658 0.78 HTT (0.41) RPS6KA5AKT1RPS6KA1SMN1; SMN2MAPT
SCHEMBL14031597 0.78 SLC2A1 (0.52) RPS6KA5AKT1RPS6KA1MAPTTP53
SCHEMBL14031559 0.78 SLC2A1 (0.43) RPS6KA5AKT1RPS6KA1SMN1; SMN2TP53

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-20080255143-A1 Inhibitors of Akt Activity SMITHKLINE BEECHAM CORPORATION (PA) 2008-10-16 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-20080255143-A1 Inhibitors of Akt Activity PI4KB, PIK3CA, AKT2 RPS6KA5 156/4885AKT1 5/4885RPS6KA1 127/4885

“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.