SCHEMBL5457054

SCHEMBL5457054

FC(F)(F)c1cc(Cl)c2nc(Nc3ccc(Oc4cccc5nsnc45)cc3)[nH]c2c1

nearest known ligand 0.41

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
KDR P35968 5/20 0.41
PDE10A Q9Y233 4/20 0.40
CBFB Q13951 1/20 0.39
CSNK1A1 P48729 2/20 0.37
CSNK1D P48730 2/20 0.37
GSK3B P49841 1/20 0.37
CSNK1G2 P78368 1/20 0.37
DYRK1A Q13627 1/20 0.36
DYRK1B Q9Y463 1/20 0.36
BRAF P15056 5/20 0.36
RAF1 P04049 3/20 0.36
PTGES O14684 3/20 0.35
TEK Q02763 2/20 0.35
ALOX5 P09917 1/20 0.34
TTBK1 Q5TCY1 1/20 0.34
TTBK2 Q6IQ55 1/20 0.34

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
SCHEMBL5454095 0.91 PDE10A (0.38) KDRPDE10ACSNK1A1CSNK1DGSK3B
SCHEMBL5453181 0.90 RIPK1 (0.40) KDRPDE10ACSNK1A1CSNK1DGSK3B
SCHEMBL5449925 0.86 KDR (0.49) KDRPDE10ACBFBCSNK1A1CSNK1D
SCHEMBL5450819 0.79 PTGES (0.45) KDRPDE10ACBFBBRAFRAF1
SCHEMBL5464243 0.79 PTGES (0.40) KDRPDE10ACBFBBRAFRAF1
SCHEMBL4164494 0.79 KDR (0.59) KDRPDE10ACBFBCSNK1A1CSNK1D
SCHEMBL5444078 0.78 PTGES (0.41) KDRBRAFRAF1PTGESALOX5
SCHEMBL5796495 0.77 PTGES (0.41) KDRBRAFRAF1PTGESALOX5
SCHEMBL4172506 0.77 KDR (0.48) KDRPDE10ACBFBCSNK1A1CSNK1D
SCHEMBL14595258 0.76 CBFB (0.39) KDRCBFBCSNK1A1CSNK1DGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20070021456-A1 Aminobenzimidazole derivatives MERCK PATENT GMBH (DE) 2007-01-25 US claimed
US-20070021456-A1 Aminobenzimidazole derivatives MERCK PATENT GMBH (DE) 2007-01-25 US disclosed
US-20070021456-A1 Aminobenzimidazole derivatives MERCK PATENT GMBH (DE) 2007-01-25 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-20070021456-A1 Aminobenzimidazole derivatives TIE1, KDR, FLT1 KDR 2/4885PDE10A 4420/4885CBFB 1061/4885

“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.