SCHEMBL9569164

SCHEMBL9569164

O=C(O)Oc1cn2c3c(c(F)c(F)cc3c1=O)OC=C2COCc1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.41
TOP1 P11387 2/20 0.37
TOP2A P11388 13/20 0.32
TOP2B Q02880 13/20 0.32
MAPT P10636 1/20 0.32
GSK3B P49841 1/20 0.31
DAO P14920 1/20 0.30

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
SCHEMBL9569160 0.90 TOP1 (0.48) STAT3TOP1TOP2ATOP2B
SCHEMBL9569144 0.89 STAT3 (0.40) STAT3TOP1MAPT
SCHEMBL9569173 0.89 STAT3 (0.39) STAT3TOP1TOP2ATOP2BMAPT
SCHEMBL9560449 0.83 TOP1 (0.39) STAT3TOP1TOP2A
SCHEMBL9560421 0.80 TOP1 (0.40) STAT3TOP1TOP2ATOP2B
SCHEMBL9569181 0.79 STAT3 (0.38) STAT3TOP1TOP2ATOP2BMAPT
SCHEMBL9513057 0.78 TOP1 (0.41) STAT3TOP1TOP2ATOP2B
SCHEMBL9569169 0.77 TOP1 (0.51) STAT3TOP1TOP2ATOP2B
SCHEMBL9560484 0.76 TOP1 (0.41) STAT3TOP1TOP2ATOP2B
Hydrochloric Acid SCHEMBL9569157 0.75 CYP11B1 (0.35) TOP1

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-0563734-A1 9-fluoro-7-oxo-7H-pyrido(1,2,3-de)(1,4)benzoxazine carboxylic acids and esters and their use as antiviral agents BAYER AG (DE) 1993-10-06 EP disclosed