SCHEMBL8819948

SCHEMBL8819948

COc1ccc(-n2cc(C3=C=CC=C3)c3ncnc(O)c32)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PI4KA P42356 1/20 0.36
PI4K2B Q8TCG2 1/20 0.36
PI4K2A Q9BTU6 1/20 0.36
PI4KB Q9UBF8 1/20 0.36
ABL1 P00519 1/20 0.34
EGFR P00533 1/20 0.34
SRC P12931 1/20 0.34
KDR P35968 1/20 0.34
ABL2 P42684 1/20 0.34
HTT P42858 3/20 0.33
ALDH1A1 P00352 6/20 0.33
MAPT P10636 6/20 0.33
KDM4E B2RXH2 5/20 0.33
TP53 P04637 2/20 0.33
HPGD P15428 2/20 0.33
LMNA P02545 2/20 0.32
PDE11A Q9HCR9 1/20 0.32
ESRRA P11474 1/20 0.32
TDP1 Q9NUW8 2/20 0.32
MEN1 O00255 2/20 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
SCHEMBL8819481 0.87 PI4KA (0.46) PI4KAPI4K2BPI4K2API4KBABL1
SCHEMBL8819719 0.76 PI4KA (0.48) PI4KAPI4K2BPI4K2API4KBABL1
SCHEMBL8819945 0.74 MAPT (0.36) PI4KAPI4K2BPI4K2API4KBABL1
SCHEMBL8819681 0.71 EGFR (0.42) PI4KAPI4K2BPI4K2API4KBABL1
SCHEMBL8819987 0.68 SRC (0.50) PI4KAPI4K2BPI4K2API4KBABL1
SCHEMBL8819507 0.65 PI4KA (0.47) PI4KAPI4K2BPI4K2API4KBABL1
SCHEMBL8819907 0.65 SRC (0.61) PI4KAPI4K2BPI4K2API4KBABL1
SCHEMBL8819985 0.63 NPC1 (0.39) PI4KAPI4K2BPI4K2API4KBABL1
SCHEMBL20911866 0.61 PI4KA (0.43) PI4KAPI4K2BPI4K2API4KBHTT
SCHEMBL8819904 0.61 PI4KA (0.44) PI4KAPI4K2BPI4K2API4KBABL1

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
WO-1997049706-A1 SUBSTITUTED 7-AMINO-PYRROLO[3,2-d]PYRIMIDINES AND THE USE THEREOF NOVARTIS AG (CH) 1997-12-31 WO disclosed