SCHEMBL13367157

SCHEMBL13367157

CCn1nc(CCO)cc1Nc1cc(Nc2cc(F)ccc2C(=O)NOC)c(I)cn1

nearest known ligand 0.41

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MAPK3 P27361 2/20 0.41
MAPK1 P28482 2/20 0.41
PTK2 Q05397 1/20 0.39
MAP2K1 Q02750 5/20 0.38
JAK1 P23458 10/20 0.35
TYK2 P29597 10/20 0.35
JAK2 O60674 5/20 0.35
PDE4D Q08499 4/20 0.35
TSHR P16473 1/20 0.34
MAP2K2 P36507 1/20 0.34
MAPK14 Q16539 1/20 0.33

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
SCHEMBL691583 0.91 PTK2 (0.49) MAPK3MAPK1PTK2MAP2K1JAK1
SCHEMBL691711 0.84 PTK2 (0.51) MAPK3MAPK1PTK2MAP2K1JAK1
SCHEMBL692007 0.81 PTK2 (0.49) MAPK3MAPK1PTK2MAP2K1JAK1
SCHEMBL1292976 0.80 PTK2 (0.60) MAPK3MAPK1PTK2MAP2K1JAK1
SCHEMBL1293166 0.75 PTK2 (0.51) MAPK3MAPK1PTK2MAP2K1JAK1
SCHEMBL690575 0.74 PTK2 (0.58) MAPK3MAPK1PTK2JAK1TYK2
SCHEMBL690567 0.70 PTK2 (0.50) PTK2MAP2K1JAK1TYK2
SCHEMBL691964 0.70 MAPK1 (0.63) MAPK3MAPK1PTK2JAK1TYK2
SCHEMBL1293001 0.70 MAPK1 (0.61) MAPK3MAPK1PTK2JAK1TYK2
SCHEMBL1293133 0.69 PTK2 (0.61) MAPK3MAPK1PTK2JAK1TYK2

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-20100113475-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK GLAXOSMITHKLINE LLC 2010-05-06 US disclosed

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-20100113475-A1 PYRAZOLYLAMINOPYRIDINES AS INHIBITORS OF FAK PTK2, PAK1, CTTN MAPK3 64/4885MAPK1 221/4885PTK2 1/4885

“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.