SCHEMBL5008580

SCHEMBL5008580

COc1cc(Nc2cc(C(C)(C)C)nn2-c2ccc(C)cc2C)c(C(N)=O)cc1OC

nearest known ligand 0.47

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BRAF P15056 8/20 0.47
CDK8 P49336 1/20 0.43
MAPK14 Q16539 7/20 0.41
MAPK12 P53778 3/20 0.41
MAPK13 O15264 2/20 0.41
MAPK11 Q15759 2/20 0.41
CSF1R P07333 1/20 0.39
HSD11B1 P28845 1/20 0.38
GSK3A P49840 1/20 0.38

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 0.84 MAPK14 (0.49) BRAFCDK8MAPK14MAPK12MAPK13
SCHEMBL5008440 0.80 MAPK14 (0.45) CDK8MAPK14MAPK12MAPK13MAPK11
SCHEMBL5008388 0.78 MAPK14 (0.53) BRAFMAPK14MAPK12MAPK13MAPK11
SCHEMBL5005312 0.75 MAPK14 (0.51) MAPK14MAPK12MAPK13MAPK11
SCHEMBL5008529 0.75 MAPK14 (0.59) CDK8MAPK14MAPK12MAPK13MAPK11
SCHEMBL5005583 0.74 GFER (0.53) MAPK14MAPK12MAPK13MAPK11
SCHEMBL14600246 0.73 MAPK13 (0.53) BRAFCDK8MAPK14MAPK12MAPK13
SCHEMBL5010626 0.72 MAPK14 (0.61) MAPK14MAPK12MAPK13MAPK11
SCHEMBL5011989 0.71 MAPK14 (0.61) BRAFCDK8MAPK14MAPK12MAPK13
SCHEMBL3974140 0.71 MAPK14 (0.46) CDK8MAPK14MAPK12MAPK13MAPK11

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 BRAF 2016/4885CDK8 1684/4885MAPK14 1938/4885

“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.