SCHEMBL19084246

SCHEMBL19084246

c1cc2c(cc#1)OCCC2

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
CLK1 P49759 1/20 0.33
DYRK1A Q13627 1/20 0.33
DYRK1B Q9Y463 1/20 0.33
CTNNB1 P35222 1/20 0.32
WNT3A P56704 1/20 0.32
NOTUM Q6P988 1/20 0.31

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
SCHEMBL15926128 0.86
SCHEMBL910334 0.72 CLK1 (0.33) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL132193 0.72 CLK1 (0.36) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL16853957 0.72 ITGB2 (0.45)
SCHEMBL909875 0.71 NOTUM (0.31) NOTUM
SCHEMBL2461000 0.70 CTNNB1 (0.34) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL28296206 0.68 ITGB2 (0.50) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL1639124 0.67 CLK1 (0.33) CLK1DYRK1ADYRK1BCTNNB1WNT3A
SCHEMBL27032744 0.67 CA1 (0.31)
SCHEMBL8447 0.65 ITGB2 (0.52) CLK1DYRK1ADYRK1BCTNNB1WNT3A

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-2017115978-A1 ORGANIC FILM COMPOSITION AND PATTERN FORMING METHOD 삼성에스디아이 주식회사 2017-07-06 WO disclosed