SCHEMBL5008529

SCHEMBL5008529

Cc1ccccc1-n1nc(C(C)(C)C)cc1Nc1ccccc1C(N)=O

nearest known ligand 0.59

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 17/20 0.59
MAPK13 O15264 12/20 0.59
MAPK12 P53778 12/20 0.59
MAPK11 Q15759 12/20 0.59
CDK8 P49336 1/20 0.45
DDR2 Q16832 2/20 0.44
NTRK1 P04629 1/20 0.43
SRC P12931 1/20 0.42
MAPK9 P45984 1/20 0.42

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
SCHEMBL5008769 0.91 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL5008643 0.90 MAPK14 (0.47) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5010659 0.90 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5012012 0.89 MAPK14 (0.50) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL5005312 0.89 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL5008388 0.87 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11
SCHEMBL5008344 0.86 GFER (0.52) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL3980152 0.86 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL27637099 0.86 MAPK14 (0.43) MAPK14MAPK13MAPK12MAPK11CDK8
SCHEMBL5008355 0.85 CDK8 (0.63) MAPK14MAPK13MAPK12MAPK11CDK8

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
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

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.