SCHEMBL4038475

SCHEMBL4038475

Oc1ccc(Nc2nnc(OCc3ccncc3)c3occc23)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.59
PDGFRB P09619 7/20 0.59
KIT P10721 6/20 0.59
FLT4 P35916 3/20 0.59
MAP3K20 Q9NYL2 2/20 0.59
ILK Q13418 1/20 0.59
FLT1 P17948 12/20 0.37
EGFR P00533 2/20 0.37
CSF1R P07333 2/20 0.37
CIT O14578 1/20 0.37
HLA-A P04439 1/20 0.37
RET P07949 1/20 0.37
PDGFRA P16234 1/20 0.37
RPS6KB1 P23443 1/20 0.37
FRK P42685 1/20 0.37
CDK8 P49336 1/20 0.37
DDR1 Q08345 1/20 0.37
STK3 Q13188 1/20 0.37
PTK6 Q13882 1/20 0.37
MAP3K19 Q56UN5 1/20 0.37

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
SCHEMBL2199182 0.90 KDR (0.68) KDRPDGFRBKITFLT4MAP3K20
SCHEMBL2202354 0.88 KDR (0.56) KDRPDGFRBKITFLT4MAP3K20
SCHEMBL4037825 0.82 KIT (0.86) KDRPDGFRBKITFLT4MAP3K20
SCHEMBL4038407 0.79 KDR (0.71) KDRPDGFRBKITFLT4MAP3K20
SCHEMBL2200373 0.76 KDR (0.80) KDRPDGFRBKITFLT4MAP3K20
SCHEMBL4037126 0.75 KIT (0.85) KDRPDGFRBKITFLT4MAP3K20
SCHEMBL4035661 0.75 KDR (0.80) KDRPDGFRBKITFLT4MAP3K20
Telatinib SCHEMBL1250560 0.74 KDR (1.00) KDRPDGFRBKITFLT4MAP3K20
SCHEMBL2200307 0.74 KDR (0.67) KDRPDGFRBKITFLT4MAP3K20
SCHEMBL4035178 0.74 KIT (0.84) KDRPDGFRBKITFLT4MAP3K20

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-1228063-B1 SUBSTITUTED PYRIDINES AND PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER CORP (US) 2009-02-11 EP claimed