SCHEMBL4936604

SCHEMBL4936604

Nc1cc(Oc2ccc(NC(=O)Nc3ccc(-c4ccccn4)c(C(F)(F)F)c3)cc2)ncn1

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 17/20 0.65
MAPK14 Q16539 13/20 0.65
TNNI3K Q59H18 13/20 0.65
BRAF P15056 13/20 0.65
S1PR1 P21453 1/20 0.53
FLT1 P17948 1/20 0.51
FLT4 P35916 1/20 0.51
CDK8 P49336 2/20 0.49

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
SCHEMBL4937060 0.88 KDR (0.66) KDRMAPK14TNNI3KBRAFS1PR1
SCHEMBL4936682 0.87 KDR (0.64) KDRMAPK14TNNI3KBRAFFLT1
SCHEMBL4933323 0.85 KDR (0.64) KDRMAPK14TNNI3KBRAFFLT1
SCHEMBL4935537 0.85 KDR (0.64) KDRMAPK14TNNI3KBRAFFLT1
SCHEMBL3174505 0.82 CDK8 (0.71) KDRMAPK14TNNI3KBRAFFLT1
SCHEMBL22528714 0.82 KDR (0.70) KDRMAPK14TNNI3KBRAFFLT1
SCHEMBL4933174 0.82 KDR (0.70) KDRMAPK14TNNI3KBRAFFLT1
SCHEMBL1896470 0.79 KDR (0.73) KDRMAPK14TNNI3KBRAFCDK8
SCHEMBL3180722 0.79 KDR (1.00) KDRMAPK14TNNI3KBRAFFLT1
SCHEMBL1894993 0.76 KDR (0.69) KDRMAPK14TNNI3KBRAFCDK8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases BOLD GUIDO 2008-12-18 US claimed
US-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases BOLD GUIDO 2008-12-18 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-20080312192-A1 Diaryl Urea Derivatives in the Treatment of Protein Kinase Dependent Diseases RET, PRKDC, PRKACA KDR 1309/4885MAPK14 343/4885TNNI3K 314/4885

“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.