SCHEMBL5056323

SCHEMBL5056323

CNc1ncc2cc(C3CC3NC(=O)Nc3cc(C(C)(C)C)nn3-c3cccc(C#N)c3)c(=O)n(C3CCCC3)c2n1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAP3K7 O43318 2/20 0.46
TAB1 Q15750 1/20 0.46
MAPK14 Q16539 13/20 0.42
MAPK12 P53778 6/20 0.42
MAPK13 O15264 5/20 0.42
MAPK11 Q15759 5/20 0.42
NTRK1 P04629 2/20 0.36
MARK3 P27448 2/20 0.36
DYRK3 O43781 1/20 0.36
RPS6KB1 P23443 1/20 0.36
FRK P42685 1/20 0.36
GSK3B P49841 1/20 0.36
MAP4K2 Q12851 1/20 0.36
STK3 Q13188 1/20 0.36
PIK3CD O00329 1/20 0.36
PRKAB2 O43741 1/20 0.36
NUAK1 O60285 1/20 0.36
CCNT1 O60563 1/20 0.36
ABL1 P00519 1/20 0.36
FYN P06241 1/20 0.36

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
SCHEMBL5054862 0.93 MAPK14 (0.42) MAP3K7TAB1MAPK14MAPK12MAPK13
SCHEMBL5061990 0.91 MAP3K7 (0.46) MAP3K7TAB1MAPK14MAPK12MAPK13
SCHEMBL5052221 0.91 MAPK14 (0.52) MAP3K7TAB1MAPK14MAPK12MAPK13
SCHEMBL5062070 0.91 NTRK1 (0.46) MAPK14MAPK12MAPK13MAPK11NTRK1
SCHEMBL5052094 0.89 MAPK14 (0.39) MAP3K7TAB1MAPK14MAPK12MAPK13
SCHEMBL5052203 0.89 NTRK1 (0.46) MAP3K7TAB1MAPK14MAPK12MAPK13
SCHEMBL5055134 0.88 MAP3K7 (0.43) MAP3K7TAB1MAPK14MAPK12MAPK13
SCHEMBL5062229 0.87 NTRK1 (0.44) MAPK14MAPK12MAPK13MAPK11NTRK1
SCHEMBL5054978 0.81 MAP3K7 (0.41) MAP3K7TAB1MAPK14MAPK12MAPK13
SCHEMBL5056355 0.81 MAPK14 (0.50) MAPK14MAPK12MAPK13MAPK11NTRK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080113967-A1 ENZYME MODULATORS AND TREATMENTS DECIPHERA PHARMACEUTICALS, LLC (US) 2008-05-15 US claimed

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-20080113967-A1 ENZYME MODULATORS AND TREATMENTS ABL2, BRAF, MAP3K1 MAP3K7 22/4885TAB1 240/4885MAPK14 100/4885

“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.