SCHEMBL5060116

SCHEMBL5060116

CNc1ncc2cc(-c3cccc(NC(=O)Nc4cc(C(C)(C)C)nn4-c4ccc(F)cc4)c3)c(=O)n(C)c2n1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BRAF P15056 4/20 0.49
NTRK1 P04629 1/20 0.47
NTRK3 Q16288 1/20 0.47
NTRK2 Q16620 1/20 0.47
MAPK14 Q16539 13/20 0.47
MAPK13 O15264 10/20 0.47
MAPK12 P53778 10/20 0.47
MAPK11 Q15759 10/20 0.47
DDR2 Q16832 1/20 0.45
PTK2 Q05397 1/20 0.45
FLT3 P36888 1/20 0.44

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
SCHEMBL5054734 0.94 MAPK14 (0.50) BRAFNTRK1NTRK3NTRK2MAPK14
SCHEMBL5052261 0.93 MAPK14 (0.55) MAPK14MAPK13MAPK12MAPK11DDR2
SCHEMBL5062104 0.91 BRAF (0.48) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5055194 0.91 BRAF (0.47) BRAFNTRK1NTRK3NTRK2MAPK14
SCHEMBL5056517 0.90 BRAF (0.46) BRAFNTRK1NTRK3NTRK2MAPK14
SCHEMBL5062046 0.89 MAPK14 (0.44) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5056366 0.89 NTRK1 (0.46) BRAFNTRK1NTRK3NTRK2MAPK14
SCHEMBL5060109 0.88 MAPK14 (0.50) BRAFMAPK14MAPK13MAPK12MAPK11
SCHEMBL5056737 0.88 BRAF (0.45) BRAFNTRK1NTRK3NTRK2MAPK14
SCHEMBL5054835 0.88 MAPK14 (0.42) 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 2/4885NTRK1 217/4885NTRK3 732/4885

“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.