SCHEMBL6598729

SCHEMBL6598729

O=C(O)Nc1cc(Cc2nnc(Nc3cccc(Br)c3)c3ccccc23)ccn1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 18/20 0.53
FLT1 P17948 11/20 0.53
PDGFRB P09619 9/20 0.53
KIT P10721 8/20 0.53
CSF1R P07333 2/20 0.47
FLT4 P35916 2/20 0.47
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
EGFR P00533 2/20 0.44
CIT O14578 1/20 0.43
HLA-A P04439 1/20 0.43
RET P07949 1/20 0.43
PDGFRA P16234 1/20 0.43
RPS6KB1 P23443 1/20 0.43
FRK P42685 1/20 0.43
CDK8 P49336 1/20 0.43
DDR1 Q08345 1/20 0.43
STK3 Q13188 1/20 0.43
PTK6 Q13882 1/20 0.43
MAP3K19 Q56UN5 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
SCHEMBL6600324 0.85 KDR (0.71) KDRFLT1PDGFRBKITCSF1R
SCHEMBL6503289 0.85 KDR (0.70) KDRFLT1PDGFRBKITCSF1R
SCHEMBL6481343 0.84 KDR (0.53) KDRFLT1PDGFRBKITCSF1R
Hydrochloric Acid SCHEMBL6599699 0.84 KDR (0.70) KDRFLT1PDGFRBKITCSF1R
SCHEMBL6473753 0.83 KDR (0.53) KDRFLT1PDGFRBKITCSF1R
SCHEMBL6504661 0.81 KDR (0.49) KDRFLT1PDGFRBKITCSF1R
SCHEMBL1930591 0.72 KDR (0.53) KDRFLT1PDGFRBKITCSF1R
SCHEMBL6609516 0.70 KDR (0.71) KDRFLT1PDGFRBKITCSF1R
SCHEMBL905704 0.70 KDR (1.00) KDRFLT1PDGFRBKITCSF1R
SCHEMBL905586 0.70 KDR (1.00) KDRFLT1PDGFRBKITCSF1R

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-1208096-B1 SUBSTITUTED PYRIDAZINES AND FUSED PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER AG (US) 2004-04-28 EP claimed