SCHEMBL2214689

SCHEMBL2214689

NCc1ccc(C(=O)Nc2ccc(Nc3nc(-c4cccc5c4oc4ccccc45)cc4ccnn34)cc2)nc1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 1/20 0.34
PLG P00747 5/20 0.34
KLK1 P06870 5/20 0.34
KLK6 Q92876 4/20 0.34
PLAU P00749 2/20 0.34
F2 P00734 1/20 0.34
PLAT P00750 1/20 0.34
PRSS1 P07477 1/20 0.34
P2RX3 P56373 1/20 0.34
CDK2 P24941 1/20 0.33
C3AR1 Q16581 1/20 0.33
MAPT P10636 5/20 0.32
HPGD P15428 4/20 0.32
SMN1; SMN2 Q16637 4/20 0.32
NPC1 O15118 2/20 0.32
RAB9A P51151 2/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
HSD17B10 Q99714 2/20 0.32
TP53 P04637 1/20 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
SCHEMBL2211370 0.91 LOXL2 (0.34) NAMPTPLGKLK1KLK6PLAU
SCHEMBL2214178 0.91 KDM4E (0.39) NAMPTPLGKLK1KLK6PLAU
SCHEMBL2211331 0.88 KDM4E (0.39) NAMPTPLGKLK1KLK6PLAU
SCHEMBL2215134 0.88 LOXL2 (0.38) NAMPTPLGKLK1PLAUF2
SCHEMBL2211719 0.88 LOXL2 (0.35) NAMPTCDK2MAPTHPGDSMN1; SMN2
SCHEMBL2253400 0.88 MEN1 (0.35) NAMPTPLGKLK1KLK6C3AR1
SCHEMBL2211773 0.87 PLG (0.38) NAMPTPLGKLK1KLK6MAPT
SCHEMBL2213647 0.86 LOXL2 (0.37) NAMPTPLGKLK1PLAUF2
SCHEMBL2215322 0.86 KDM4E (0.37) NAMPTPLGKLK1PLAUF2
SCHEMBL2213715 0.85 SMN1; SMN2 (0.38) PLGKLK1PLAUF2PLAT

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
EP-1797096-B1 PYRAZOLOPYRIMIDINES AS INHIBITORS OF PROTEIN KINASE B (AKT) BAYER SCHERING PHARMA AG (DE) 2011-07-27 EP disclosed