SCHEMBL5056355

SCHEMBL5056355

CNc1ncc2cc(C3CC3NC(=O)Nc3cc(C(C)(C)C)nn3-c3ccccc3)c(=O)n(C)c2n1

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 15/20 0.50
MAPK13 O15264 14/20 0.50
MAPK12 P53778 14/20 0.50
MAPK11 Q15759 14/20 0.50
NTRK1 P04629 4/20 0.46
JAK2 O60674 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
SCHEMBL5052163 0.93 NTRK1 (0.51) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5056309 0.93 NTRK1 (0.48) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5055029 0.92 NTRK1 (0.51) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5062233 0.91 MAPK14 (0.47) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5061990 0.90 MAP3K7 (0.46) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5054654 0.90 MAPK14 (0.46) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5052221 0.90 MAPK14 (0.52) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5054966 0.90 MAPK14 (0.38) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5052162 0.90 MAPK14 (0.38) MAPK14MAPK13MAPK12MAPK11NTRK1
SCHEMBL5059916 0.89 NTRK1 (0.38) MAPK14MAPK13MAPK12MAPK11NTRK1

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 MAPK14 100/4885MAPK13 118/4885MAPK12 99/4885

“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.