SCHEMBL5457042

SCHEMBL5457042

FC(F)(F)c1cc(Cl)c2nc(Nc3ccc(OC4=CC=CN5SNC=C45)cc3)[nH]c2c1

nearest known ligand 0.36

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
KDR P35968 4/20 0.36
CBFB Q13951 1/20 0.34
EGLN1 Q9GZT9 1/20 0.33
PDE10A Q9Y233 3/20 0.32
RAF1 P04049 2/20 0.32
BRAF P15056 2/20 0.32
CSNK1A1 P48729 1/20 0.31
CSNK1D P48730 1/20 0.31
GSK3B P49841 1/20 0.31
CSNK1G2 P78368 1/20 0.31
PTGES O14684 2/20 0.31
TTBK1 Q5TCY1 2/20 0.31
TTBK2 Q6IQ55 2/20 0.31
TEK Q02763 1/20 0.31

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
SCHEMBL5454087 0.92 RAF1 (0.33) KDRPDE10ARAF1BRAFCSNK1A1
SCHEMBL5453176 0.90 RIPK1 (0.38) KDREGLN1PDE10ARAF1BRAF
SCHEMBL5766491 0.88 KDR (0.36) KDRPDE10ARAF1BRAFCSNK1A1
SCHEMBL5449919 0.80 KDR (0.36) KDRCBFBEGLN1PDE10ARAF1
SCHEMBL5450812 0.75 RIPK1 (0.36) KDREGLN1TEK
SCHEMBL4164494 0.75 KDR (0.59) KDRCBFBPDE10ARAF1BRAF
SCHEMBL5450929 0.73
SCHEMBL4164886 0.72 KDR (0.41) KDRCBFBPDE10ARAF1BRAF
SCHEMBL5449925 0.72 KDR (0.49) KDRCBFBPDE10ARAF1BRAF
SCHEMBL5449786 0.72 CBFB (0.34) CBFBEGLN1PTGES

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-20070021456-A1 Aminobenzimidazole derivatives MERCK PATENT GMBH (DE) 2007-01-25 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-20070021456-A1 Aminobenzimidazole derivatives TIE1, KDR, FLT1 KDR 2/4885CBFB 1061/4885EGLN1 319/4885

“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.