SCHEMBL5055053

SCHEMBL5055053

CC(C)c1cc(NC(=O)Nc2ccc(Oc3ccnc(NS(C)(=O)=O)c3)cc2)n(-c2ccc3ncncc3c2)n1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ABL1 P00519 4/20 0.58
SRC P12931 4/20 0.58
AXL P30530 1/20 0.49
BRAF P15056 4/20 0.46
RAF1 P04049 4/20 0.45
MAPK14 Q16539 7/20 0.43
MAPK13 O15264 3/20 0.42
FLT3 P36888 1/20 0.41
MAPK12 P53778 1/20 0.41
MAPK11 Q15759 1/20 0.41
KCNJ6 P48051 1/20 0.41
KCNJ5 P48544 1/20 0.41
KCNJ3 P48549 1/20 0.41
SYK P43405 1/20 0.40
GSK3A P49840 1/20 0.40

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
SCHEMBL5052349 0.91 MAPK14 (0.49) ABL1SRCAXLBRAFRAF1
SCHEMBL5062099 0.90 BRAF (0.49) ABL1SRCAXLBRAFRAF1
SCHEMBL5056544 0.90 ABL1 (0.60) ABL1SRCAXLBRAFRAF1
SCHEMBL5059942 0.90 ABL1 (0.60) ABL1SRCAXLBRAFRAF1
SCHEMBL5054751 0.90 ABL1 (0.62) ABL1SRCAXLBRAFRAF1
SCHEMBL5052225 0.89 ABL1 (0.74) ABL1SRCAXLBRAFRAF1
SCHEMBL5055252 0.85 MAPK14 (0.51) ABL1SRCAXLBRAFMAPK14
SCHEMBL5054990 0.85 BRAF (0.46) ABL1SRCAXLBRAFRAF1
SCHEMBL5055215 0.85 ABL1 (0.60) ABL1SRCAXLBRAFRAF1
SCHEMBL5054782 0.84 BRAF (0.47) ABL1SRCAXLBRAFRAF1

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 20/4885SRC 69/4885AXL 117/4885

“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.