SCHEMBL6495745

SCHEMBL6495745

c1ccc2c(Nc3ccc(Oc4ccncc4)cc3)nnc(Cc3ccncc3)c2c1

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 19/20 0.76
FLT1 P17948 14/20 0.76
PDGFRB P09619 12/20 0.76
KIT P10721 11/20 0.73
CSF1R P07333 2/20 0.73
FLT4 P35916 2/20 0.73
CIT O14578 1/20 0.73
EGFR P00533 1/20 0.73
HLA-A P04439 1/20 0.73
RET P07949 1/20 0.73
PDGFRA P16234 1/20 0.73
RPS6KB1 P23443 1/20 0.73
FRK P42685 1/20 0.73
CDK8 P49336 1/20 0.73
DDR1 Q08345 1/20 0.73
STK3 Q13188 1/20 0.73
PTK6 Q13882 1/20 0.73
MAP3K19 Q56UN5 1/20 0.73
CDK19 Q9BWU1 1/20 0.73
MAP3K20 Q9NYL2 1/20 0.73

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
SCHEMBL905595 0.89 KDR (0.86) KDRFLT1PDGFRBKITCSF1R
SCHEMBL6607478 0.87 KDR (0.71) KDRFLT1PDGFRBKITCSF1R
SCHEMBL905634 0.87 KDR (1.00) KDRFLT1PDGFRBKITCSF1R
SCHEMBL905654 0.86 KDR (0.80) KDRFLT1PDGFRBKITCSF1R
Hydrochloric Acid SCHEMBL6610350 0.85 KDR (0.97) KDRFLT1PDGFRBKITCSF1R
SCHEMBL905608 0.85 KDR (0.80) KDRFLT1PDGFRBKITCSF1R
SCHEMBL12668209 0.85 KDR (0.80) KDRFLT1PDGFRBKITCSF1R
SCHEMBL905620 0.85 KDR (0.80) KDRFLT1PDGFRBKITCSF1R
SCHEMBL905658 0.85 KDR (0.80) KDRFLT1PDGFRBKITCSF1R
Vatalanib SCHEMBL29350047 0.85 FLT1 (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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6903101-B1 Substituted pyridazines and fused pyridazines with angiogenesis inhibiting activity BAYER PHARMACEUTICALS CORPORATION (US) 2005-06-07 US claimed
EP-1208096-B1 SUBSTITUTED PYRIDAZINES AND FUSED PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER AG (US) 2004-04-28 EP claimed
EP-1208096-A1 SUBSTITUTED PYRIDAZINES AND FUSED PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY Bayer Corporation (US) 2002-05-29 EP claimed
WO-2001010859-A1 SUBSTITUTED PYRIDAZINES AND FUSED PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER CORPORATION (US) 2001-02-15 WO claimed
US-6903101-B1 Substituted pyridazines and fused pyridazines with angiogenesis inhibiting activity BAYER PHARMACEUTICALS CORPORATION (US) 2005-06-07 US disclosed
EP-1208096-B1 SUBSTITUTED PYRIDAZINES AND FUSED PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER AG (US) 2004-04-28 EP disclosed
EP-1208096-A1 SUBSTITUTED PYRIDAZINES AND FUSED PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY Bayer Corporation (US) 2002-05-29 EP disclosed
WO-2001010859-A1 SUBSTITUTED PYRIDAZINES AND FUSED PYRIDAZINES WITH ANGIOGENESIS INHIBITING ACTIVITY BAYER CORPORATION (US) 2001-02-15 WO disclosed