SCHEMBL14023802

SCHEMBL14023802

C1=C\c2cccc(c2)Nc2nccc(n2)-c2ccc(s2)COC/1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 20/20 0.54
JAK2 O60674 19/20 0.54
TYK2 P29597 17/20 0.54
CDK2 P24941 16/20 0.54
JAK1 P23458 13/20 0.54
JAK3 P52333 4/20 0.54
KCNH2 Q12809 1/20 0.54
CCNA2 P20248 8/20 0.44
CCNA1 P78396 8/20 0.44

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
SCHEMBL14023829 1.00 FLT3 (0.54) FLT3JAK2TYK2CDK2JAK1
SCHEMBL14022785 0.79 FLT3 (0.76) FLT3JAK2TYK2CDK2JAK1
SCHEMBL1108258 0.70 JAK2 (1.00) FLT3JAK2TYK2CDK2JAK1
SCHEMBL824031 0.70 FLT3 (0.71) FLT3JAK2TYK2CDK2JAK1
SCHEMBL20322485 0.69 FLT3 (0.82) FLT3JAK2TYK2CDK2JAK1
SCHEMBL14022737 0.67 JAK2 (0.82) FLT3JAK2TYK2CDK2JAK1
SCHEMBL823868 0.67 JAK2 (1.00) FLT3JAK2TYK2CDK2JAK1
SCHEMBL1108269 0.65 FLT3 (1.00) FLT3JAK2TYK2CDK2JAK1
SCHEMBL1108253 0.65 FLT3 (1.00) FLT3JAK2TYK2CDK2JAK1
SCHEMBL823965 0.65 JAK2 (0.78) FLT3JAK2TYK2CDK2JAK1

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-2008140420-A2 PYRIMIDINE DERIVATIVES S*BIO PTE LTD (SG) 2008-11-20 WO disclosed