SCHEMBL5264876

SCHEMBL5264876

COc1ccc(-c2nc3nc(C)ccn3c2-c2ccc(N)cc2)cc1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AKT1 P31749 2/20 0.51
AKT2 P31751 2/20 0.51
RAD51 Q06609 1/20 0.44
MAPK13 O15264 2/20 0.43
MAPK12 P53778 2/20 0.43
MAPK11 Q15759 2/20 0.43
MAPK14 Q16539 2/20 0.43
USP7 Q93009 1/20 0.43
ALDH1A1 P00352 4/20 0.41
KDM4E B2RXH2 3/20 0.41
HPGD P15428 2/20 0.41
NPC1 O15118 2/20 0.41
RAB9A P51151 2/20 0.41
HTT P42858 1/20 0.41
TDP1 Q9NUW8 2/20 0.41
MAPK1 P28482 1/20 0.41
TP53 P04637 1/20 0.40
MAPT P10636 1/20 0.40
NFKB1 P19838 1/20 0.40
NFKB2 Q00653 1/20 0.40

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
SCHEMBL5262520 0.88 AKT1 (0.47) AKT1AKT2MAPK13MAPK12MAPK11
SCHEMBL5262073 0.87 AKT1 (0.48) AKT1AKT2MAPK13MAPK12MAPK11
SCHEMBL5261912 0.86 AKT1 (0.47) AKT1AKT2MAPK13MAPK12MAPK11
SCHEMBL6100692 0.85 AKT1 (0.47) AKT1AKT2MAPK13MAPK12MAPK11
SCHEMBL5264520 0.83 AKT1 (0.45) AKT1AKT2MAPK13MAPK12MAPK11
SCHEMBL5261530 0.83 AKT1 (0.47) AKT1AKT2MAPK13MAPK12MAPK11
SCHEMBL5263795 0.82 AKT1 (0.49) AKT1AKT2MAPK13MAPK12MAPK11
SCHEMBL5262166 0.82 APP (0.45) AKT1AKT2ALDH1A1KDM4EHPGD
SCHEMBL5261780 0.81 ALDH1A1 (0.65) AKT1AKT2RAD51MAPK13MAPK12
SCHEMBL5789311 0.81 GAA (0.43) AKT1AKT2MAPK14ALDH1A1KDM4E

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
EP-1660500-B1 SUBSTITUTED IMIDAZOPYRIMIDINES FOR THE PREVENTION AND TREATMENT OF CANCER S A L V A T LAB SA (ES) 2007-12-12 EP disclosed
US-20060189631-A1 Substituted imidazopyrimidines for the prevention and treatment of cancer LABORATORIOS S.A.L.V.A.T., S.A. (ES) 2006-08-24 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-20060189631-A1 Substituted imidazopyrimidines for the prevention and treatment of cancer BRCA1, CCNA1, DPYD AKT1 3579/4885AKT2 3297/4885RAD51 201/4885

“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.