SCHEMBL5176743

SCHEMBL5176743

CCc1nn(CC)cc1NC1CCOCC1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 6/20 0.39
PDE7A Q13946 1/20 0.39
MAPK1 P28482 4/20 0.38
BRD4 O60885 2/20 0.34
JAK2 O60674 1/20 0.34
JAK1 P23458 1/20 0.34
TYK2 P29597 1/20 0.34
STAT3 P40763 1/20 0.34
JAK3 P52333 1/20 0.34
EML4 Q9HC35 1/20 0.34
ALK Q9UM73 1/20 0.34
LRRK2 Q5S007 3/20 0.33
IRAK4 Q9NWZ3 1/20 0.33
FYN P06241 1/20 0.33
MKNK1 Q9BUB5 1/20 0.33
PDE1B Q01064 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
SCHEMBL4762000 0.90 ALDH1A1 (0.35) PDE4BPDE7A
SCHEMBL6437921 0.88 PDE4B (0.40) PDE4BPDE7AMAPK1BRD4JAK2
SCHEMBL4552449 0.87 RAB9A (0.40) PDE4BPDE7ALRRK2
SCHEMBL4555150 0.85 RAB9A (0.42) PDE4BPDE7ALRRK2
SCHEMBL5185734 0.83 PDE7A (0.39) PDE4BPDE7AEML4ALK
SCHEMBL6444159 0.81 LRRK2 (0.38) PDE4BPDE7AMAPK1BRD4EML4
SCHEMBL5175998 0.78 BPTF (0.41) BRD4IRAK4
SCHEMBL6450335 0.76 KHK (0.31)
SCHEMBL3422561 0.73 LMNA (0.38) PDE4BPDE7ABRD4
SCHEMBL4554789 0.72 ALDH1A1 (0.49) MAPK1BRD4JAK1

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
EP-1737857-A1 PYRAZOLO[3,4-B] PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2007-01-03 EP disclosed
WO-2005058892-A1 PYRAZOLO [3,4-B] PYRIDINE COMPOUNDS, AND THEIR USE AS PHOSPHODIESTERASE INHIBITORS GLAXO GROUP LIMITED (GB) 2005-06-30 WO disclosed