SCHEMBL8662852

SCHEMBL8662852

Nc1ncnc2nc(Cl)sc12

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LIMK1 P53667 8/20 0.46
CDK5 Q00535 3/20 0.46
AURKA O14965 3/20 0.46
PRKACA P17612 3/20 0.46
ROCK1 Q13464 3/20 0.46
DYRK1A Q13627 3/20 0.46
AURKB Q96GD4 3/20 0.46
DAPK3 O43293 2/20 0.46
PRKD3 O94806 2/20 0.46
MAP4K4 O95819 2/20 0.46
CSNK1A1 P48729 2/20 0.46
CLK2 P49760 2/20 0.46
NEK2 P51955 2/20 0.46
PIM3 Q86V86 2/20 0.46
CLK4 Q9HAZ1 2/20 0.46
LRRK2 Q5S007 2/20 0.46
NTRK1 P04629 1/20 0.46
PDGFRA P16234 1/20 0.46
LTK P29376 1/20 0.46
GRK5 P34947 1/20 0.46

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
SCHEMBL6993509 0.78 LIMK1 (0.42) LIMK1CDK5AURKAPRKACAROCK1
SCHEMBL22743993 0.71 TLR8 (0.43) LIMK1CDK5AURKAPRKACAROCK1
SCHEMBL25594273 0.71 NUDT1 (0.45) LIMK1CDK5AURKAPRKACAROCK1
SCHEMBL29853821 0.71 NUDT1 (0.45) LIMK1CDK5AURKAPRKACAROCK1
SCHEMBL29853803 0.68 PIK3CD (0.52) KDM4ENPC1USP2ALDH1A1MAPT
SCHEMBL4923588 0.65 PI4KA (0.47) LIMK1CDK5AURKAPRKACAROCK1
SCHEMBL21206862 0.64 AURKA (0.35) LIMK1CDK5AURKAPRKACAROCK1
SCHEMBL1892669 0.64 LTA4H (0.42) LIMK1CDK5AURKAPRKACAROCK1
SCHEMBL21206761 0.62 AURKA (0.33) LIMK1CDK5AURKAPRKACAROCK1
SCHEMBL15305912 0.62 AXL (0.34) AXLMKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0636372-B1 Antiviral, antitumor, antimetastatic, immune system enhancing 7-thia-guanosine derivatives ICN PHARMACEUTICALS (US) 1998-12-02 EP disclosed
EP-0348446-B1 ANTIVIRAL ANTITUMOR ANTIMETASTATIC IMMUNE SYSTEM ENHANCING NUCLEOSIDES AND NUCLEOTIDES UNIV BRIGHAM YOUNG (US) 1995-08-09 EP disclosed
EP-0636372-A1 Antiviral, antitumor, antimetastatic, immune system enhancing 7-thia-guanosine derivatives BRIGHAM YOUNG UNIVERSITY (US) 1995-02-01 EP disclosed
EP-0348446-A4 ANTIVIRAL ANTITUMOR ANTIMETASTATIC IMMUNE SYSTEM ENHANCING NUCLEOSIDES AND NUCLEOTIDES 1991-09-25 EP disclosed
US-5041426-A Viricides, antitumor agents BRIGHAM YOUNG UNIVERSITY (US) 1991-08-20 US disclosed
EP-0348446-A1 ANTIVIRAL ANTITUMOR ANTIMETASTATIC IMMUNE SYSTEM ENHANCING NUCLEOSIDES AND NUCLEOTIDES. UNIV BRIGHAM YOUNG (US) 1990-01-03 EP disclosed
US-4880784-A ANTITUMOR AGENTS BRIGHAM YOUNG UNIVERSITY (US) 1989-11-14 US disclosed
WO-1989005649-A1 ANTIVIRAL ANTITUMOR ANTIMETASTATIC IMMUNE SYSTEM ENHANCING NUCLEOSIDES AND NUCLEOTIDES BRIGHAM YOUNG UNIVERSITY (US) 1989-06-29 WO disclosed