SCHEMBL5807295

SCHEMBL5807295

CCNc1[nH]nc(-c2ccccc2)c1-c1ccc(=O)n(-c2ccccc2C)n1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK11 Q15759 5/20 0.44
MAPK13 O15264 4/20 0.44
CYP2C9 P11712 1/20 0.44
FGFR1 P11362 1/20 0.40
FGFR2 P21802 1/20 0.40
FGFR3 P22607 1/20 0.40
MAPK14 Q16539 5/20 0.37
ALDH1A1 P00352 4/20 0.37
MAPK12 P53778 3/20 0.37
MAPT P10636 2/20 0.37
KDM4E B2RXH2 1/20 0.37
PDE4A P27815 1/20 0.34
PDE4B Q07343 1/20 0.34
PDE4C Q08493 1/20 0.34
PDE4D Q08499 1/20 0.34
EGFR P00533 1/20 0.33
TSHR P16473 1/20 0.33
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 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
SCHEMBL5812295 0.92 MAPK13 (0.53) MAPK11MAPK13CYP2C9FGFR1FGFR2
SCHEMBL5808593 0.88 MAPK11 (0.44) MAPK11MAPK13CYP2C9FGFR1FGFR2
SCHEMBL5811120 0.87 ADORA3 (0.40) MAPK11MAPK13CYP2C9FGFR1MAPK14
SCHEMBL5812439 0.86 HTR1A (0.37) MAPK11MAPK13CYP2C9ALDH1A1MAPT
SCHEMBL5811997 0.82 MAPK11 (0.57) MAPK11MAPK13CYP2C9FGFR1FGFR2
SCHEMBL4246294 0.82 MAPK11 (0.55) MAPK11MAPK13CYP2C9FGFR1FGFR2
SCHEMBL4243633 0.81 MAPK13 (0.49) MAPK11MAPK13CYP2C9FGFR1FGFR2
SCHEMBL5811657 0.81 MAPK11 (0.54) MAPK11MAPK13CYP2C9FGFR1FGFR2
SCHEMBL5806880 0.81 MAPK13 (0.50) MAPK11MAPK13CYP2C9FGFR1FGFR2
SCHEMBL4760876 0.80 MAPK13 (0.51) MAPK11MAPK13CYP2C9FGFR1FGFR2

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-2006038734-A1 PYRIDAZINONE DERIVATIVES CYTOKINES INHIBITORS ASTELLAS PHARMA INC. (JP) 2006-04-13 WO disclosed