SCHEMBL6494070

SCHEMBL6494070

N#CC(c1ccncc1)c1nnc(Nc2ccc3ncsc3c2)c2ccccc12

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
FLT1 P17948 4/20 0.44
KDR P35968 4/20 0.44
PRKD1 Q15139 1/20 0.42
TGFBR1 P36897 1/20 0.41
RIPK2 O43353 3/20 0.39
SYK P43405 1/20 0.39
LRRK2 Q5S007 1/20 0.38
IKBKB O14920 4/20 0.38
RIPK1 Q13546 1/20 0.38
RIPK3 Q9Y572 2/20 0.36
IRAK4 Q9NWZ3 3/20 0.35
GFER P55789 1/20 0.35
PDGFRB P09619 3/20 0.35
KIT P10721 3/20 0.35
MAP4K1 Q92918 1/20 0.34

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
SCHEMBL2229449 0.80 TGFBR1 (0.56) KDRPRKD1TGFBR1RIPK2SYK
SCHEMBL6495541 0.77 FLT1 (0.46) FLT1KDRPDGFRBKIT
SCHEMBL2200375 0.75 MAPT (0.50) FLT1KDRPRKD1TGFBR1RIPK2
SCHEMBL6598802 0.75 FLT1 (0.64) FLT1KDRPDGFRBKIT
SCHEMBL2197137 0.73 TGFBR1 (0.50) FLT1KDRPRKD1TGFBR1RIPK2
SCHEMBL2202465 0.71 EGFR (0.61) KDRPRKD1TGFBR1
SCHEMBL2201774 0.71 PRKD1 (0.46) FLT1KDRPRKD1TGFBR1RIPK2
SCHEMBL2198086 0.70 TGFBR1 (0.52) KDRPRKD1TGFBR1RIPK2SYK
SCHEMBL2199656 0.69 RIPK2 (0.47) KDRPRKD1TGFBR1RIPK2SYK
SCHEMBL2197036 0.69 ABCG2 (0.54) FLT1KDRPRKD1TGFBR1RIPK2

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 6 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-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-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