SCHEMBL9568343

SCHEMBL9568343

O=C(O)c1c2n(c3c(F)c(-c4ccccc4)c(F)cc3c1=O)C(c1ccccc1)S2

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 17/20 0.42
TOP2B Q02880 17/20 0.42
PIM1 P11309 2/20 0.38
GSK3A P49840 2/20 0.38
GSK3B P49841 2/20 0.38
PIM3 Q86V86 2/20 0.38
CSNK1G1 Q9HCP0 1/20 0.38
LMNA P02545 1/20 0.32
PRKD3 O94806 1/20 0.31
IRAK1 P51617 1/20 0.31
RPS6KA3 P51812 1/20 0.31
DYRK1A Q13627 1/20 0.31
CSNK1G3 Q9Y6M4 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
SCHEMBL9568312 0.93 TOP2A (0.41) TOP2ATOP2BPIM1GSK3AGSK3B
SCHEMBL9568460 0.91 TOP2A (0.39) TOP2ATOP2BPIM1GSK3AGSK3B
SCHEMBL9568467 0.87 GSK3B (0.36) TOP2ATOP2BPIM1GSK3AGSK3B
SCHEMBL9568329 0.86 MAPT (0.41) TOP2ATOP2BLMNA
SCHEMBL9568437 0.86 PIM1 (0.43) TOP2ATOP2BPIM1GSK3AGSK3B
SCHEMBL9231610 0.84 TOP2A (0.41) TOP2ATOP2BPIM1GSK3AGSK3B
SCHEMBL9568342 0.81 TOP1 (0.34) TOP2ATOP2BPIM1GSK3AGSK3B
SCHEMBL9568305 0.81 MAPT (0.38) TOP2ATOP2BLMNA
SCHEMBL9674781 0.80 PIM1 (0.49) TOP2APIM1GSK3AGSK3BPIM3
SCHEMBL9568291 0.80 MAPT (0.37) TOP2ATOP2BLMNA

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-0551518-A1 QUINOLINECARBOXYLIC ACID DERIVATIVE NIPPON SHINYAKU COMPANY, LIMITED (JP) 1993-07-21 EP disclosed