SCHEMBL5437698

SCHEMBL5437698

NC(=O)c1ncn(-c2ccc(NC(=O)Nc3cccc(OC(F)(F)F)c3)cc2)c1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FLT3 P36888 1/20 0.49
KDR P35968 3/20 0.48
AURKA O14965 1/20 0.48
AURKB Q96GD4 1/20 0.48
BRAF P15056 3/20 0.47
EPHX2 P34913 3/20 0.45
MEN1 O00255 1/20 0.44
TP53 P04637 1/20 0.44
MAPT P10636 1/20 0.44
CASP3 P42574 1/20 0.44
HTT P42858 1/20 0.44
KMT2A Q03164 1/20 0.44
NPSR1 Q6W5P4 1/20 0.44
SENP7 Q9BQF6 1/20 0.44
NAMPT P43490 1/20 0.44
EPHA3 P29320 1/20 0.44
EPHB4 P54760 1/20 0.44
CDK8 P49336 3/20 0.43
CDK7 P50613 1/20 0.43
CDK6 Q00534 1/20 0.43

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
SCHEMBL5436578 0.86 KDR (0.64) FLT3KDRAURKAAURKBBRAF
SCHEMBL5447368 0.81 KDR (0.52) FLT3KDRAURKAAURKBKMT2A
SCHEMBL5440835 0.81 KDR (0.53) FLT3KDRAURKAAURKBBRAF
SCHEMBL5447759 0.81 EPHA3 (0.47) FLT3KDRBRAFEPHX2MEN1
SCHEMBL4865620 0.80 PTK2 (0.54) FLT3KDRAURKAAURKBBRAF
SCHEMBL27673027 0.80 KDR (0.44) FLT3KDRAURKAAURKBEPHA3
SCHEMBL5449198 0.79 CDK8 (0.53) FLT3KDRAURKAAURKBBRAF
SCHEMBL27673022 0.79 KDR (0.41) KDRAURKAAURKBEPHX2TP53
SCHEMBL5440797 0.78 KDR (0.57) KDRCDK8
SCHEMBL5440740 0.77 RIPK1 (0.51) KDRAURKAAURKBBRAFEPHX2

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-20070225347-A1 Imidazole Derivatives MERCK PATENT GMBH (DE) 2007-09-27 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-20070225347-A1 Imidazole Derivatives TIE1, FLT1, FER FLT3 7/4885KDR 4/4885AURKA 302/4885

“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.