SCHEMBL5795836

SCHEMBL5795836

Cc1ccccc1-n1nc(-c2oc(N3CCC(CNC(=O)O)C3)nc2-c2ccc(F)cc2F)ccc1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 6/20 0.48
MAPK11 Q15759 6/20 0.48
MAPK12 P53778 5/20 0.48
MAPK14 Q16539 5/20 0.48
CYP2C9 P11712 1/20 0.41
CHRM4 P08173 2/20 0.34
CHRM2 P08172 1/20 0.34
RPS6KB1 P23443 1/20 0.34
CREBBP Q92793 1/20 0.33
FGFR1 P11362 1/20 0.33
FGFR2 P21802 1/20 0.33
FGFR3 P22607 1/20 0.33
USP30 Q70CQ3 1/20 0.33
CKS1B P61024 1/20 0.33
SKP1 P63208 1/20 0.33
SKP2 Q13309 1/20 0.33
KMT2A Q03164 3/20 0.33
POLB P06746 2/20 0.33
GAA P10253 1/20 0.33
CHRM3 P20309 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
SCHEMBL5798471 0.88 MAPK11 (0.52) MAPK13MAPK11MAPK12MAPK14CYP2C9
SCHEMBL5795840 0.86 MAPK11 (0.48) MAPK13MAPK11MAPK12MAPK14CYP2C9
SCHEMBL5795927 0.86 MAPK11 (0.53) MAPK13MAPK11MAPK12MAPK14CYP2C9
SCHEMBL5795633 0.85 MAPK11 (0.49) MAPK13MAPK11MAPK12MAPK14CYP2C9
SCHEMBL5796486 0.85 MAPK11 (0.51) MAPK13MAPK11MAPK12MAPK14CYP2C9
SCHEMBL5796468 0.85 MAPK11 (0.52) MAPK13MAPK11MAPK12MAPK14CYP2C9
SCHEMBL5795644 0.83 MAPK11 (0.52) MAPK13MAPK11MAPK12MAPK14CYP2C9
SCHEMBL5799290 0.78 MAPK14 (0.49) MAPK13MAPK11MAPK12MAPK14CYP2C9
SCHEMBL5795756 0.76 MAPK11 (0.61) MAPK13MAPK11MAPK12MAPK14CYP2C9
SCHEMBL5799438 0.76 MAPK11 (0.61) MAPK13MAPK11MAPK12MAPK14CYP2C9

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