SCHEMBL5010717

SCHEMBL5010717

CC(C)(C)c1cc(Nc2ccccc2C(N)=O)n(-c2ccccc2)n1

nearest known ligand 0.57

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 14/20 0.57
MAPK13 O15264 13/20 0.57
MAPK12 P53778 13/20 0.57
MAPK11 Q15759 13/20 0.57
JAK2 O60674 1/20 0.56
GAA P10253 1/20 0.55
CDK8 P49336 1/20 0.53
GRN P28799 1/20 0.52
SORT1 Q99523 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
NTRK1 P04629 1/20 0.52

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
SCHEMBL5008355 0.93 CDK8 (0.63) MAPK14MAPK13MAPK12MAPK11JAK2
SCHEMBL5011989 0.90 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL27617940 0.89 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11JAK2
SCHEMBL28757659 0.87 MAPK14 (0.63) MAPK14MAPK13MAPK12MAPK11JAK2
SCHEMBL5012012 0.85 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL5008529 0.85 MAPK14 (0.59) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL14600240 0.84 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11JAK2
SCHEMBL5008769 0.83 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL27637099 0.82 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11JAK2
SCHEMBL5005312 0.81 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100448869-C Anilinopyrazole derivatives for the treatment of diabetes BAYER PHARMACEUTICALS CORP (US) 2009-01-07 CN disclosed
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2008-03-13 US disclosed
US-7265144-B2 Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORPORATION (US) 2007-09-04 US disclosed
CN-1717401-A Anilinopyrazole derivatives useful for the treatment of diabetes BAYER PHARMACEUTICALS CORP (US) 2006-01-04 CN disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080064734-A1 Anilinopyrazole derivatives useful for the treatment of diabetes IAPP, GLP1R, GPR119 MAPK14 1938/4885MAPK13 885/4885MAPK12 1488/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.