SCHEMBL6261492

SCHEMBL6261492

O=C(Nc1cn2ccnc2c(NC2CCC(O)CC2)n1)c1ccccc1

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 19/20 0.50
ADORA3 P0DMS8 1/20 0.48
TMIGD3 P0DMS9 1/20 0.48
MAST3 O60307 4/20 0.47
MAPK9 P45984 2/20 0.46

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
SCHEMBL6265215 0.82 BTK (0.58) ADORA3TMIGD3
SCHEMBL6264936 0.79 MAPK8 (0.58) MAPK8ADORA3TMIGD3
SCHEMBL6262920 0.78 POLB (0.45) MAPK8
SCHEMBL6262086 0.77 SYK (0.60) MAPK8MAST3
SCHEMBL6264925 0.76 MAPK8 (0.57) MAPK8ADORA3TMIGD3MAST3MAPK9
SCHEMBL6260383 0.76 SYK (0.59) MAPK8ADORA3TMIGD3
SCHEMBL6268219 0.74 MAPK8 (0.52) MAPK8MAST3MAPK9
SCHEMBL6260435 0.74 SYK (0.61) MAPK8ADORA3TMIGD3MAST3
SCHEMBL6260272 0.74 MAPK8 (0.49) MAPK8MAST3MAPK9
SCHEMBL6264246 0.73 AURKA (0.60) MAPK8ADORA3TMIGD3

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-2005085252-A1 IMIDAZO ‘1,2-A’ PYRAZINE COMPOUNDS WHICH INTERACT WITH PROTEIN KINASES BIOFOCUS DISCOVERY LIMITED (GB) 2005-09-15 WO claimed