SCHEMBL31079596

SCHEMBL31079596

Cc1nc(CNC(=O)CO)ncc1-n1c(C)cc(OCc2ccc(F)cc2F)c(Br)c1=O

nearest known ligand 0.70

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.70
ROCK2 O75116 1/20 0.57
MAPK12 P53778 1/20 0.57
MAPK11 Q15759 1/20 0.57
STRADA Q7RTN6 1/20 0.57

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
SCHEMBL5863014 1.00 MAPK14 (0.70) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL3520919 0.88 MAPK14 (0.56) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL29594751 0.85 MAPK14 (0.66) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL5861996 0.85 MAPK14 (0.66) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL6499957 0.84 MAPK14 (0.80) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL29593356 0.83 MAPK14 (0.64) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL5862045 0.83 MAPK14 (0.64) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL29594719 0.83 MAPK14 (0.64) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL21097388 0.83 MAPK14 (0.64) MAPK14ROCK2MAPK12MAPK11STRADA
SCHEMBL5862110 0.83 MAPK14 (0.64) MAPK14ROCK2MAPK12MAPK11STRADA

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 2 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