SCHEMBL5060447

SCHEMBL5060447

CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(-c4cn[nH]c4)c3)cc2)n(-c2ccc(C#N)nc2)n1

nearest known ligand 0.55

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 3/20 0.55
BRAF P15056 13/20 0.55
MAPK14 Q16539 2/20 0.55
ABL1 P00519 3/20 0.52
AXL P30530 1/20 0.52
SRC P12931 2/20 0.51
FLT3 P36888 1/20 0.48
RAF1 P04049 1/20 0.47

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
SCHEMBL5060048 0.92 MAPK13 (0.58) MAPK13BRAFMAPK14ABL1AXL
SCHEMBL5054828 0.90 MAPK14 (0.58) MAPK13BRAFMAPK14ABL1AXL
SCHEMBL5062000 0.89 MAP3K7 (0.61) MAPK13BRAFMAPK14ABL1AXL
SCHEMBL5062147 0.88 BRAF (0.62) MAPK13BRAFMAPK14ABL1AXL
SCHEMBL5054612 0.88 MAPK13 (0.55) MAPK13BRAFMAPK14ABL1AXL
SCHEMBL5060009 0.85 ABL1 (0.58) MAPK13BRAFMAPK14ABL1AXL
SCHEMBL5062447 0.85 MAPK13 (0.59) MAPK13BRAFMAPK14ABL1AXL
SCHEMBL5052361 0.85 BRAF (0.46) MAPK13BRAFMAPK14AXLRAF1
SCHEMBL5052992 0.85 ABL1 (0.56) MAPK13BRAFMAPK14ABL1AXL
SCHEMBL5054904 0.85 MAPK14 (0.61) MAPK13BRAFMAPK14ABL1AXL

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 MAPK13 118/4885BRAF 2/4885MAPK14 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.