SCHEMBL11240332

SCHEMBL11240332

CC(Cn1nc(NC=O)c2cc(-c3ccncc3)cnc21)OC=O

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR1D1 P20393 1/20 0.37
AXL P30530 1/20 0.33
PDGFRB P09619 2/20 0.31
PDGFRA P16234 2/20 0.31
KDM4C Q9H3R0 2/20 0.31
KDM4E B2RXH2 2/20 0.31
ALDH1A1 P00352 2/20 0.31
MAPT P10636 2/20 0.31
HPGD P15428 2/20 0.31
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP3A4 P08684 1/20 0.31
ALOX15 P16050 1/20 0.31
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
CYP2C19 P33261 1/20 0.31
KMT2A Q03164 1/20 0.31
HSD17B10 Q99714 1/20 0.31
PTPN11 Q06124 1/20 0.31
GSK3A P49840 1/20 0.31

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
SCHEMBL11229725 0.87 NR1D1 (0.37) NR1D1AXLPDGFRBPDGFRAKDM4C
SCHEMBL11236571 0.81 NR1D1 (0.33) NR1D1AXLPDGFRBPDGFRAKDM4E
SCHEMBL11231822 0.79 GSK3A (0.37) NR1D1AXLKDM4CKDM4EALDH1A1
SCHEMBL11228877 0.77 GSK3B (0.45) NR1D1AXLPDGFRBPDGFRAKDM4C
SCHEMBL11232705 0.73 PDGFRB (0.38) NR1D1AXLPDGFRBPDGFRAKDM4C
SCHEMBL11229063 0.71 CCNC (0.36) KDM4C
SCHEMBL11128094 0.69 NR1D1 (0.40) NR1D1AXLPDGFRBPDGFRAKDM4C
SCHEMBL11222288 0.69 MEN1 (0.40) NR1D1AXLKDM4EALDH1A1MAPT
SCHEMBL11225319 0.68 LATS1 (0.40) NR1D1AXLPDGFRBPDGFRAKDM4E
SCHEMBL11232201 0.68 GSK3B (0.48) NR1D1PDGFRBPDGFRAKDM4EALDH1A1

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
US-4361568-A 5-(Pyridinyl)-1H-pyrazolo[3,4-b]pyridin-3-amines and their cardiotonic use STERLING DRUG INC. (US) 1982-11-30 US disclosed
EP-0063754-A1 Pyrazolopyridine derivatives, and preparation, useful as cardiotonics STERLING DRUG INC. (US) 1982-11-03 EP disclosed