SCHEMBL5740512

SCHEMBL5740512

CCOC(=O)Oc1cn2ncnc(Nc3ccc(C)c(O)c3)c2c1OC(=O)OCC

nearest known ligand 0.72

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.72
EGFR P00533 4/20 0.59
FLT1 P17948 1/20 0.54
FLT4 P35916 1/20 0.54

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
SCHEMBL5740579 0.95 KDR (0.77) KDREGFRFLT1FLT4
SCHEMBL5739706 0.94 KDR (0.70) KDREGFRFLT1FLT4
SCHEMBL5740197 0.90 KDR (0.66) KDREGFRFLT1FLT4
SCHEMBL5739838 0.88 KDR (0.75) KDREGFRFLT1FLT4
SCHEMBL5740298 0.88 KDR (0.75) KDREGFRFLT1FLT4
SCHEMBL5739905 0.87 KDR (0.59) KDREGFRFLT1FLT4
SCHEMBL5740630 0.85 KDR (0.61) KDREGFRFLT1FLT4
SCHEMBL4047212 0.84 KDR (1.00) KDREGFRFLT1FLT4
SCHEMBL4049387 0.83 KDR (0.88) KDREGFRFLT1FLT4
SCHEMBL5739951 0.82 KDR (0.71) KDREGFRFLT1FLT4

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
EP-1183033-B1 PYRROLOTRIAZINE INHIBITORS OF KINASES BRISTOL MYERS SQUIBB CO (US) 2006-03-01 EP claimed