SCHEMBL686667

SCHEMBL686667

Nc1cc2c(Nc3ccc(NC(=O)c4ccc(F)cc4C(F)(F)F)cc3)ncnc2[nH]c1=O

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
AURKA O14965 11/20 0.57
AURKB Q96GD4 4/20 0.57
CHEK2 O96017 1/20 0.57
CSF1R P07333 1/20 0.57
RET P07949 1/20 0.57
FLT4 P35916 1/20 0.57
ABL2 P42684 1/20 0.57
BLK P51451 1/20 0.57
LIMK1 P53667 1/20 0.57
KDR P35968 5/20 0.44
KIT P10721 1/20 0.43
FLT3 P36888 1/20 0.41
PTGS1 P23219 1/20 0.40
TTBK1 Q5TCY1 1/20 0.39
TTBK2 Q6IQ55 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
SCHEMBL686029 0.87 AURKA (0.53) AURKAAURKBCHEK2CSF1RRET
SCHEMBL678002 0.86 AURKA (0.71) AURKAAURKBCHEK2CSF1RRET
SCHEMBL686486 0.77 AURKA (0.54) AURKAAURKBKDR
SCHEMBL679036 0.77 PTGS1 (0.52) AURKAAURKBCHEK2CSF1RRET
SCHEMBL679178 0.76 AURKA (0.74) AURKAAURKBCHEK2CSF1RRET
SCHEMBL679167 0.74 AURKA (0.71) AURKAAURKBCHEK2CSF1RRET
SCHEMBL6525630 0.74 AURKA (0.88) AURKAAURKBCHEK2CSF1RRET
SCHEMBL6525760 0.74 AURKA (0.88) AURKAAURKBCHEK2CSF1RRET
SCHEMBL6522604 0.73 AURKA (1.00) AURKAAURKBCHEK2CSF1RRET
SCHEMBL679057 0.72 AURKA (0.67) AURKAAURKBCHEK2CSF1RRET

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-20110269758-A1 NAPHTHYRIDINONES AS PROTEIN KINASE INHIBITORS MERCK PATENT GMBH (DE) 2011-11-03 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-20110269758-A1 NAPHTHYRIDINONES AS PROTEIN KINASE INHIBITORS AURKA, AURKC, AURKB AURKA 1/4885AURKB 3/4885CHEK2 129/4885

“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.