SCHEMBL709714

SCHEMBL709714

Nc1ncnn2ccc(C(=O)Nc3ccc(NC(=O)Nc4ccccc4)cc3)c12

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AURKB Q96GD4 11/20 0.81
AURKA O14965 10/20 0.81
LCK P06239 3/20 0.78
LYN P07948 3/20 0.78
PIM1 P11309 3/20 0.78
MARK3 P27448 3/20 0.78
BLK P51451 3/20 0.78
STK3 Q13188 3/20 0.78
MARK2 Q7KZI7 3/20 0.78
IRAK4 Q9NWZ3 3/20 0.78
NTRK1 P04629 3/20 0.78
NTRK2 Q16620 3/20 0.78
PDPK1 O15530 2/20 0.78
CDK1 P06493 2/20 0.78
JAK3 P52333 2/20 0.78
FYN P06241 2/20 0.78
KDR P35968 2/20 0.78
FLT3 P36888 2/20 0.78
MAPK9 P45984 2/20 0.78
GSK3A P49840 2/20 0.78

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
SCHEMBL711553 0.94 AURKB (0.81) AURKBAURKALCKLYNPIM1
SCHEMBL709131 0.91 AURKB (0.70) AURKBAURKALCKLYNPIM1
SCHEMBL708728 0.89 AURKB (0.80) AURKBAURKALCKLYNPIM1
SCHEMBL710637 0.89 AURKB (1.00) AURKBAURKALCKLYNPIM1
SCHEMBL707814 0.89 AURKB (0.72) AURKBAURKALCKLYNPIM1
SCHEMBL707878 0.88 AURKA (0.72) AURKBAURKALCKLYNPIM1
SCHEMBL709155 0.88 AURKB (0.77) AURKBAURKALCKLYNPIM1
SCHEMBL709079 0.88 AURKB (1.00) AURKBAURKALCKLYNPIM1
SCHEMBL710323 0.88 AURKB (1.00) AURKBAURKALCKLYNPIM1
SCHEMBL707252 0.86 AURKA (0.83) AURKBAURKALCKLYNPIM1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8124759-B2 Inhibitors of protein kinases ABBOTT LABORATORIES (US) 2012-02-28 US claimed
US-20090131425-A1 INHIBITORS OF PROTEIN KINASES ABBOTT LABORATORIES (US) 2009-05-21 US claimed
US-8124759-B2 Inhibitors of protein kinases ABBOTT LABORATORIES (US) 2012-02-28 US disclosed
WO-2009136966-A1 INHIBITORS OF PROTEIN KINASES ABBOTT LABORATORIES (US) 2009-11-12 WO disclosed
US-20090131425-A1 INHIBITORS OF PROTEIN KINASES ABBOTT LABORATORIES (US) 2009-05-21 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-20090131425-A1 INHIBITORS OF PROTEIN KINASES AURKC, AURKB, PLK1 AURKB 2/4885AURKA 4/4885LCK 316/4885

“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.