SCHEMBL5056459

SCHEMBL5056459

CC(C)(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(-c4cn[nH]c4)c3)cc2)n(-c2ccc3ocnc3c2)n1

nearest known ligand 0.54

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 3/20 0.54
AXL P30530 1/20 0.54
MAPK13 O15264 2/20 0.53
BRAF P15056 13/20 0.53
MAPK14 Q16539 2/20 0.53
SRC P12931 2/20 0.52
FLT3 P36888 1/20 0.48
PTK2 Q05397 1/20 0.46

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
SCHEMBL5056290 0.91 MAPK14 (0.56) ABL1AXLBRAFMAPK14SRC
SCHEMBL5062338 0.88 ABL1 (0.56) ABL1AXLMAPK13BRAFMAPK14
SCHEMBL5052992 0.87 ABL1 (0.56) ABL1AXLMAPK13BRAFMAPK14
SCHEMBL5062147 0.86 BRAF (0.62) ABL1AXLMAPK13BRAFMAPK14
SCHEMBL5055240 0.86 ABL1 (0.54) ABL1AXLMAPK13BRAFMAPK14
SCHEMBL5062003 0.85 ABL1 (0.76) ABL1AXLMAPK13BRAFMAPK14
SCHEMBL5062447 0.85 MAPK13 (0.59) ABL1AXLMAPK13BRAFMAPK14
SCHEMBL5060009 0.85 ABL1 (0.58) ABL1AXLMAPK13BRAFMAPK14
SCHEMBL5055170 0.85 ABL1 (0.72) ABL1AXLMAPK13BRAFMAPK14
SCHEMBL5054904 0.84 MAPK14 (0.61) ABL1AXLMAPK13BRAFMAPK14

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 ABL1 20/4885AXL 117/4885MAPK13 118/4885

“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.