SCHEMBL29693530

SCHEMBL29693530

CCOC(=O)C(=O)Nc1ccc(Oc2ccnc3cc(OC)c(OC)cc23)c(F)c1

nearest known ligand 0.64

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PDGFRA P16234 1/20 0.64
MET P08581 15/20 0.63
AXL P30530 5/20 0.63
KDR P35968 3/20 0.63
FLT3 P36888 3/20 0.61
AURKA O14965 1/20 0.59
ABL1 P00519 1/20 0.59
LCK P06239 1/20 0.59
SRC P12931 1/20 0.59
FER P16591 1/20 0.59
CDK8 P49336 1/20 0.59
TYRO3 Q06418 1/20 0.59
MERTK Q12866 1/20 0.59
MAP2K5 Q13163 1/20 0.59
AURKB Q96GD4 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
SCHEMBL407651 1.00 PDGFRA (0.64) PDGFRAMETAXLKDRFLT3
SCHEMBL371919 0.88 PDGFRA (0.66) PDGFRAMETAXLKDRFLT3
SCHEMBL19373219 0.87 PDGFRA (0.69) PDGFRAMETAXLKDRFLT3
SCHEMBL2744790 0.87 PDGFRA (0.69) PDGFRAMETAXLKDRFLT3
SCHEMBL371539 0.85 MET (0.70) PDGFRAMETAXLKDRAURKA
SCHEMBL20525878 0.85 PDGFRA (0.47) PDGFRAMETAXLKDRFLT3
SCHEMBL5056203 0.85 PDGFRA (0.72) PDGFRAMETAXLKDRFLT3
SCHEMBL3113049 0.84 PDGFRA (0.71) PDGFRAMETAXLKDRFLT3
SCHEMBL4401175 0.82 MET (0.76) PDGFRAMETAXLKDRFLT3
SCHEMBL14971061 0.82 AXL (0.59) PDGFRAMETAXLKDRFLT3

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-3329918-B1 C-MET MODULATORS AND METHODS OF USE EXELIXIS INC (US) 2022-05-25 EP disclosed