SCHEMBL3947313

SCHEMBL3947313

COc1cccc(NC(=O)Nc2ccc3nc(Nc4ncnc5cc(OCCN(C)C)c(OC)cc45)sc3c2)c1

nearest known ligand 0.62

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.62
FLT4 P35916 3/20 0.54
PDGFRB P09619 2/20 0.54
EGFR P00533 6/20 0.51
RAF1 P04049 1/20 0.51
BRAF P15056 1/20 0.51
KIT P10721 1/20 0.51
RET P07949 1/20 0.51
SRC P12931 1/20 0.51
AURKA O14965 2/20 0.49
GMPS P49915 1/20 0.47
FLT1 P17948 1/20 0.47

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
SCHEMBL3953837 0.96 KDR (0.62) KDRFLT4PDGFRBEGFRRAF1
SCHEMBL3946532 0.92 KDR (0.74) KDRFLT4PDGFRBEGFRRAF1
SCHEMBL3954134 0.87 EGFR (0.54) KDRFLT4PDGFRBEGFRRET
SCHEMBL3951600 0.87 KDR (0.49) KDREGFRBRAFRET
SCHEMBL3947459 0.87 KDR (0.61) KDRFLT4PDGFRBEGFRRAF1
SCHEMBL3947281 0.86 EGFR (0.69) KDRFLT4PDGFRBEGFRBRAF
SCHEMBL3947811 0.85 KDR (0.59) KDRFLT4EGFRRAF1BRAF
SCHEMBL3949805 0.85 KDR (0.70) KDREGFRBRAFRETSRC
SCHEMBL3947263 0.84 KDR (0.72) KDREGFRKITRETAURKA
SCHEMBL4589861 0.84 KDR (0.55) KDRFLT4PDGFRBEGFRRAF1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
US-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
US-7514460-B2 Benzazole analogues and uses thereof 4SC AG (DE) 2009-04-07 US disclosed
US-20060135782-A1 Benzazole analogues and uses thereof 4SC AG (DE) 2006-06-22 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-20060135782-A1 Benzazole analogues and uses thereof DCK, SBK3, DAPK3 KDR 1657/4885FLT4 1741/4885PDGFRB 528/4885

“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.