SCHEMBL9569148

SCHEMBL9569148

CCOC(=O)Oc1cn2c3c(c(F)c(F)cc3c1=O)OC(C1CC1)=C2

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.38
CNR1 P21554 1/20 0.38
CNR2 P34972 1/20 0.38
ADRB2 P07550 1/20 0.35
TOP1 P11387 2/20 0.35
KCNH2 Q12809 1/20 0.32
KDM4E B2RXH2 4/20 0.32
KMT2A Q03164 4/20 0.32
HPGD P15428 2/20 0.32
HSD17B10 Q99714 2/20 0.32
ALDH1A1 P00352 1/20 0.32
CYP2C19 P33261 1/20 0.32
TYMS P04818 1/20 0.31
TOP2A P11388 2/20 0.31
TOP2B Q02880 2/20 0.31
HTT P42858 1/20 0.30
MEN1 O00255 1/20 0.30
LMNA P02545 1/20 0.30
MAPT P10636 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
SCHEMBL9512987 0.86 STAT3 (0.39) STAT3CNR1CNR2ADRB2TOP1
SCHEMBL9569195 0.86 TOP1 (0.40) CNR1CNR2TOP1KDM4EALDH1A1
SCHEMBL9560141 0.85 STAT3 (0.39) STAT3CNR1CNR2ADRB2TOP1
SCHEMBL9569159 0.84 STAT3 (0.41) STAT3CNR1CNR2ADRB2TOP1
SCHEMBL9569175 0.83 KDM4E (0.47) TOP1KCNH2KDM4EHPGDHSD17B10
SCHEMBL9560567 0.83 STAT3 (0.37) STAT3CNR1CNR2ADRB2TOP1
SCHEMBL9560518 0.83 STAT3 (0.37) STAT3CNR1CNR2ADRB2TOP1
SCHEMBL9560451 0.81 STAT3 (0.36) STAT3CNR1CNR2ADRB2TOP1
SCHEMBL9510131 0.81 TOP1 (0.36) STAT3CNR1CNR2ADRB2TOP1
SCHEMBL9569165 0.80 STAT3 (0.38) STAT3CNR1CNR2ADRB2TOP1

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