SCHEMBL5813626

SCHEMBL5813626

COc1cc2c(Oc3ccc(NC(=O)c4ccccc4)cc3)ccnc2cc1OCCCO

nearest known ligand 0.70

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 11/20 0.70
KIT P10721 4/20 0.70
KDR P35968 8/20 0.68
AXL P30530 3/20 0.67
MET P08581 4/20 0.65
HDAC1 Q13547 1/20 0.65
AURKB Q96GD4 1/20 0.61
IRAK4 Q9NWZ3 1/20 0.61
FGFR2 P21802 1/20 0.59

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
SCHEMBL10189185 0.94 PDGFRA (0.71) PDGFRAKITKDRAXLMET
SCHEMBL5815596 0.92 PDGFRA (0.69) PDGFRAKITKDRAXLMET
SCHEMBL4223563 0.92 PDGFRA (0.81) PDGFRAKITKDRAXLMET
SCHEMBL5814824 0.91 PDGFRA (0.68) PDGFRAKITKDRAXLMET
SCHEMBL2063467 0.89 PDGFRA (0.65) PDGFRAKITKDRAXLMET
SCHEMBL2063474 0.89 PDGFRA (0.65) PDGFRAKITKDRAXLMET
SCHEMBL2064560 0.89 PDGFRA (0.65) PDGFRAKITKDRAXLMET
SCHEMBL2062554 0.88 PDGFRA (0.71) PDGFRAKITKDRAXLMET
SCHEMBL2064084 0.88 PDGFRA (0.71) PDGFRAKITKDRAXLMET
SCHEMBL2063288 0.87 PDGFRA (0.65) PDGFRAKITKDRAXLMET

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
WO-2006117570-A1 QUINOLINE DERIVATIVES AS KINASE ENZYME INHIBITORS CHROMA THERAPEUTICS LTD (GB) 2006-11-09 WO disclosed