SCHEMBL5466701

SCHEMBL5466701

CCC(=O)Nc1nc2cc(Oc3ccc(NC(=O)Nc4cccc(C(F)(F)F)c4)cn3)ccc2[nH]1

nearest known ligand 0.57

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDR P35968 11/20 0.57
TEK Q02763 4/20 0.57
NPC1 O15118 1/20 0.55
MAPT P10636 1/20 0.55
SAE1 Q9UBE0 1/20 0.51
UBA2 Q9UBT2 1/20 0.51
MAPK14 Q16539 7/20 0.49
TNNI3K Q59H18 7/20 0.49
BRAF P15056 5/20 0.49
NTRK1 P04629 2/20 0.49
RAB9A P51151 1/20 0.48
CDK8 P49336 2/20 0.48
GAA P10253 1/20 0.48

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
SCHEMBL5352526 0.91 KDR (0.60) KDRTEKNPC1MAPTSAE1
SCHEMBL5349903 0.90 KDR (0.71) KDRTEKNPC1MAPTMAPK14
SCHEMBL7013365 0.90 KDR (0.58) KDRTEKNPC1MAPTSAE1
SCHEMBL5466696 0.82 MAPT (0.55) KDRTEKNPC1MAPTSAE1
SCHEMBL5349168 0.81 TEK (0.79) KDRTEKCDK8
SCHEMBL7017029 0.80 KDR (0.65) KDRTEKMAPTMAPK14TNNI3K
SCHEMBL5357494 0.80 KDR (0.86) KDRTEKMAPK14TNNI3KBRAF
SCHEMBL5350261 0.80 KDR (0.70) KDRTEKMAPK14TNNI3K
SCHEMBL7017943 0.80 KDR (0.71) KDRTEKMAPK14TNNI3KBRAF
SCHEMBL5348189 0.79 TEK (0.88) KDRTEK

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-20070249600-A1 CHEMICAL COMPOUNDS CHEUNG MUI 2007-10-25 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-20070249600-A1 CHEMICAL COMPOUNDS TIE1, KDR, FLT4 KDR 2/4885TEK 5/4885NPC1 4097/4885

“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.