SCHEMBL5055063

SCHEMBL5055063

CC(C)Nc1cc(Oc2ccc(NC(=O)Nc3cc(C(C)C)nn3-c3ccc4c(c3)CN(C)CC4)cc2)ccn1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
BRAF P15056 4/20 0.47
MAPK14 Q16539 10/20 0.46
MAPK13 O15264 3/20 0.42
MAPK12 P53778 1/20 0.42
MAPK11 Q15759 1/20 0.42
SRC P12931 3/20 0.42
GSK3A P49840 3/20 0.42
SYK P43405 2/20 0.42
KCNJ6 P48051 1/20 0.42
KCNJ5 P48544 1/20 0.42
KCNJ3 P48549 1/20 0.42
ABL1 P00519 2/20 0.41
AXL P30530 1/20 0.41
KDR P35968 2/20 0.41
RAF1 P04049 1/20 0.39
FLT3 P36888 1/20 0.39

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
SCHEMBL5054799 0.98 BRAF (0.46) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5055282 0.93 MAPK14 (0.47) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5052187 0.91 MAPK13 (0.55) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5055116 0.91 ABL1 (0.48) BRAFMAPK14MAPK13MAPK11SRC
SCHEMBL5060306 0.91 BRAF (0.45) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5055021 0.90 MAPK14 (0.47) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5062157 0.88 MAPK13 (0.54) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5054976 0.88 ABL1 (0.49) BRAFMAPK14MAPK13MAPK11SRC
SCHEMBL5055248 0.87 MAPK14 (0.57) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5054898 0.86 ABL1 (0.53) BRAFMAPK14MAPK13MAPK12MAPK11

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 BRAF 2/4885MAPK14 100/4885MAPK13 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.