SCHEMBL4052301

SCHEMBL4052301

Cc1ccc(Nc2ncnn3cc(C(=O)O)c(C(=O)O)c23)cc1O

nearest known ligand 0.69

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
KDR P35968 20/20 0.69
EGFR P00533 4/20 0.67
FLT1 P17948 1/20 0.61
FLT4 P35916 1/20 0.61

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
SCHEMBL5516114 0.90 KDR (0.80) KDREGFRFLT1FLT4
SCHEMBL28747311 0.86 KDR (0.69) KDREGFRFLT1FLT4
SCHEMBL27888151 0.86 KDR (0.78) KDREGFRFLT1FLT4
SCHEMBL27871854 0.83 KDR (0.62) KDREGFRFLT1FLT4
SCHEMBL4044227 0.83 KDR (0.79) KDREGFRFLT1FLT4
SCHEMBL5515554 0.83 KDR (0.81) KDREGFRFLT1FLT4
SCHEMBL4051578 0.82 KDR (1.00) KDREGFR
SCHEMBL4045525 0.80 KDR (1.00) KDREGFRFLT1FLT4
SCHEMBL5741783 0.79 KDR (0.71) KDREGFRFLT1FLT4
SCHEMBL4049037 0.78 KDR (0.81) KDREGFR

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
EP-1669071-B1 Pyrrolotriazine inhibitors of kinases BRISTOL MYERS SQUIBB CO (US) 2009-07-22 EP disclosed
EP-1669071-A1 Pyrrolotriazine inhibitors of kinases BRISTOL-MYERS SQUIBB COMPANY (US) 2006-06-14 EP disclosed