SCHEMBL4946019

SCHEMBL4946019

c1c[nH]c(-c2ncnc3nc[nH]c23)n1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 2/20 0.47
PI4K2B Q8TCG2 2/20 0.47
PI4K2A Q9BTU6 2/20 0.47
PI4KB Q9UBF8 2/20 0.47
LRRK2 Q5S007 2/20 0.47
LMNA P02545 1/20 0.47
DRD3 P35462 1/20 0.47
XDH P47989 1/20 0.47
G6PD P11413 1/20 0.46
HTT P42858 3/20 0.45
MAP3K5 Q99683 1/20 0.45
AKT2 P31751 6/20 0.44
PRKACA P17612 3/20 0.43
PDPK1 O15530 2/20 0.43
TP53 P04637 2/20 0.43
PRKACG P22612 2/20 0.43
PRKACB P22694 2/20 0.43
HSD17B10 Q99714 2/20 0.43
CHEK1 O14757 1/20 0.43
AURKA O14965 1/20 0.43

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
SCHEMBL30862619 0.75 PI4KA (0.55) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL4943558 0.75 PDPK1 (0.54) LMNAMAP3K5PDPK1CDK2CYP1A2
SCHEMBL7035594 0.74 PI4KA (0.50) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL1989291 0.71 NISCH (0.40) CYP1A2
SCHEMBL3778190 0.70 AKT2 (0.48) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL7027245 0.70 AKT2 (0.47) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL19288719 0.70 AKT2 (0.54) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL2938675 0.69 AKT2 (0.70) AKT2PRKACAPRKACGPRKACBCDC7
SCHEMBL3492637 0.69 AKT2 (0.50) PI4KAPI4K2BPI4K2API4KBLRRK2
SCHEMBL655396 0.68 PDPK1 (0.47) PI4KAPI4K2BPI4K2API4KBLRRK2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1895841-A2 METHODS FOR SELECTIVE N-9 GLYCOSYLATION OF PURINES Brigham Young University (US) 2008-03-12 EP claimed
WO-2006138396-A2 METHODS FOR SELECTIVE N-9 GLYCOSYLATION OF PURINES BRIGHAM YOUNG UNIVERSITY, TRANSFER TECHNOLOGY OFFICE (US) 2006-12-28 WO claimed
US-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods ZHONG MINGHONG (US) 2015-12-31 US disclosed
EP-1895841-A2 METHODS FOR SELECTIVE N-9 GLYCOSYLATION OF PURINES Brigham Young University (US) 2008-03-12 EP disclosed
WO-2006138396-A2 METHODS FOR SELECTIVE N-9 GLYCOSYLATION OF PURINES BRIGHAM YOUNG UNIVERSITY, TRANSFER TECHNOLOGY OFFICE (US) 2006-12-28 WO disclosed
WO-2002018404-A9 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C HOFFMANN LA ROCHE (CH) 2003-10-02 WO disclosed
EP-1315736-A2 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C F. HOFFMANN-LA ROCHE AG (CH) 2003-06-04 EP disclosed
WO-2002018404-A2 NUCLEOSIDE DERIVATIVES FOR THE TREATMENT OF HEPATITIS C F. HOFFMANN-LA ROCHE AG (CH) 2002-03-07 WO disclosed
US-5849769-A N-arylalkyl-N-heteroarylurea and guandine compounds and methods of treating HIV infection MEDIVIR AB (SE) 1998-12-15 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-20150376219-A1 Selective Preparations of Purine Nucleosides and Nucleotides: Reagents and Methods PNP, ATIC, NT5C3B PI4KA 718/4885PI4K2B 753/4885PI4K2A 997/4885

“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.