SCHEMBL17040084

SCHEMBL17040084

C=C/C=C\C(=C/C)Nc1ncc(C)c(CCc2ccccc2CC(N)=O)n1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ FLT4 P35916 8/20 0.41
▸ PTK2 Q05397 14/20 0.41

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
SCHEMBL15524461 0.74 FLT4 (0.59) FLT4PTK2
SCHEMBL15524806 0.73 FLT4 (0.41) FLT4PTK2
SCHEMBL17040085 0.73 FLT4 (0.71) FLT4PTK2
SCHEMBL15524343 0.72 FLT4 (0.75) FLT4PTK2
SCHEMBL15524144 0.72 FLT4 (0.71) FLT4PTK2
SCHEMBL15524513 0.70 FLT4 (0.59) FLT4PTK2
SCHEMBL15524667 0.70 PTK2 (0.67) FLT4PTK2
SCHEMBL15524141 0.69 FLT4 (0.53) FLT4PTK2
SCHEMBL15523729 0.69 PTK2 (0.77) FLT4PTK2
SCHEMBL17040086 0.69 FLT4 (0.59) FLT4PTK2

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-2015123722-A1 INHIBITORS BIONOMICS LIMITED (AU) 2015-08-27 — — WO disclosed
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