SCHEMBL4302218

SCHEMBL4302218

CC(C)c1cc(NC(=O)Nc2cccc3ccccc23)n(-c2cccc(C(O)C(F)(F)F)c2)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NTRK1 P04629 2/20 0.56
MAPK14 Q16539 13/20 0.56
MAPK13 O15264 3/20 0.56
MAPK12 P53778 3/20 0.56
MAPK11 Q15759 3/20 0.56
DDR2 Q16832 3/20 0.54
MAPK9 P45984 3/20 0.54
SRC P12931 1/20 0.54
KCNJ6 P48051 5/20 0.52
KCNJ5 P48544 5/20 0.52
KCNJ3 P48549 5/20 0.52
CDK8 P49336 4/20 0.50
PKN2 Q16513 2/20 0.50
JAK3 P52333 1/20 0.48
DYRK3 O43781 1/20 0.48
RPS6KB1 P23443 1/20 0.48
MARK3 P27448 1/20 0.48
FRK P42685 1/20 0.48
GSK3B P49841 1/20 0.48
MAP4K2 Q12851 1/20 0.48

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
SCHEMBL4051125 0.92 MAPK14 (0.58) NTRK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL3292888 0.88 MAPK14 (0.74) NTRK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL16317150 0.88 NTRK1 (0.53) NTRK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL4048212 0.82 MAPK14 (0.62) NTRK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL4051787 0.81 NTRK1 (0.73) NTRK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL4303810 0.81 NTRK1 (0.60) NTRK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL4294709 0.81 MAPK14 (0.62) NTRK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL3293873 0.80 MAPK14 (0.74) NTRK1MAPK14MAPK13MAPK12MAPK11
SCHEMBL3295723 0.80 MAPK14 (0.76) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL16317165 0.80 MAPK14 (0.56) NTRK1MAPK14MAPK13MAPK12MAPK11

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
US-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC 2009-12-17 US disclosed
US-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS DECIPHERA PHARMACEUTICALS, LLC 2009-12-17 US disclosed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 US disclosed
US-20070191336-A1 p38 kinase inhibitors DECIPHERA PHARMACEUTICALS, LLC 2007-08-16 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 (2 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-20090312349-A1 ANTI-INFLAMMATORY MEDICAMENTS ABL2, ABL1, PTK2 NTRK1 399/4885MAPK14 80/4885MAPK13 183/4885
US-20070191336-A1 p38 kinase inhibitors MAPK1, MAP3K8, MAP3K1 NTRK1 892/4885MAPK14 29/4885MAPK13 41/4885

“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.