SCHEMBL29594239

SCHEMBL29594239

Cc1ccccc1-n1nc(-c2c(-c3ccc(F)cc3F)nn3c2NCC(CN(C)C)C3)ccc1=O

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MAPK11 Q15759 9/20 0.67
MAPK13 O15264 8/20 0.67
CYP2C9 P11712 1/20 0.67
MAPK14 Q16539 8/20 0.49
MAPK12 P53778 7/20 0.49
FGFR1 P11362 1/20 0.34
FGFR2 P21802 1/20 0.34
FGFR3 P22607 1/20 0.34
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL13928940 1.00 MAPK11 (0.67) MAPK11MAPK13CYP2C9MAPK14MAPK12
SCHEMBL4236615 1.00 MAPK11 (0.67) MAPK11MAPK13CYP2C9MAPK14MAPK12
SCHEMBL29594441 0.94 MAPK11 (0.67) MAPK11MAPK13CYP2C9MAPK14MAPK12
SCHEMBL4236748 0.94 MAPK11 (0.67) MAPK11MAPK13CYP2C9MAPK14MAPK12
SCHEMBL4237696 0.93 MAPK11 (0.66) MAPK11MAPK13CYP2C9MAPK14MAPK12
SCHEMBL29593298 0.93 MAPK11 (0.66) MAPK11MAPK13CYP2C9MAPK14MAPK12
SCHEMBL4712606 0.93 MAPK11 (0.66) MAPK11MAPK13CYP2C9MAPK14MAPK12
SCHEMBL29593890 0.93 MAPK11 (0.65) MAPK11MAPK13CYP2C9MAPK14MAPK12
SCHEMBL4241029 0.93 MAPK11 (0.65) MAPK11MAPK13CYP2C9MAPK14MAPK12
SCHEMBL4246001 0.91 MAPK11 (0.69) MAPK11MAPK13CYP2C9MAPK14MAPK12

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114748622-B P38 kinase inhibitors reduce DUX4 and downstream gene expression and treat FSHD 弗尔康医疗公司 2024-09-24 CN disclosed
CN-114732910-B P38 kinase inhibitors reduce DUX4 and downstream gene expression and treat FSHD 弗尔康医疗公司 2024-08-23 CN disclosed
CN-114748622-A P38 kinase inhibitors reduce DUX4 and downstream gene expression for the treatment of FSHD 弗尔康医疗公司 2022-07-15 CN disclosed
CN-114732910-A P38 kinase inhibitor reduces DUX4 and downstream gene expression for treatment of FSHD 弗尔康医疗公司 2022-07-12 CN disclosed
CN-111601593-B P38 kinase inhibitor reduces DUX4 and downstream gene expression for treatment of FSHD 弗尔康医疗公司 2022-04-15 CN disclosed