SCHEMBL2667285

SCHEMBL2667285

Cc1c(I)cnc2ccsc12

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.42
PARP1 P09874 1/20 0.42
AXL P30530 1/20 0.40
MKNK1 Q9BUB5 1/20 0.40
MKNK2 Q9HBH9 1/20 0.40
ADORA2A P29274 13/20 0.37
ADORA1 P30542 12/20 0.37
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
ADORA2B P29275 4/20 0.35
ADORA3 P0DMS8 3/20 0.34
RAB9A P51151 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
SPR P35270 1/20 0.33

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
SCHEMBL15655284 0.77 AXL (0.40) PDPK1PARP1AXLMKNK1MKNK2
SCHEMBL34461816 0.77 AXL (0.40) PDPK1PARP1AXLMKNK1MKNK2
SCHEMBL15654873 0.77 AXL (0.48) PDPK1PARP1AXLMKNK1MKNK2
SCHEMBL14369942 0.73 SRC (0.46) PDPK1PARP1AXLMKNK1MKNK2
SCHEMBL15736808 0.72 SPR (0.46) PDPK1PARP1AXLMKNK1MKNK2
SCHEMBL17305955 0.70 PDPK1 (0.40) PDPK1PARP1AXLMKNK1MKNK2
SCHEMBL29631094 0.69 AXL (0.44) PDPK1PARP1AXLMKNK1MKNK2
SCHEMBL21393430 0.69 AXL (0.44) PDPK1PARP1AXLMKNK1MKNK2
SCHEMBL14266837 0.69 AXL (0.48) PDPK1PARP1AXLMKNK1MKNK2
SCHEMBL15883606 0.68 KDM4E (0.39) PDPK1PARP1ADORA2AMEN1KMT2A

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-2007117381-A2 2 -AMINOPYRIDINE ANALOGS AS GLUCOKINASE ACTIVATORS ARRAY BIOPHARMA INC. (US) 2007-10-18 WO disclosed