SCHEMBL9560451

SCHEMBL9560451

CCOC(=O)Oc1cn2c3c(c(F)c(F)cc3c1=O)OC(c1ccc(C)cc1)=C2

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
STAT3 P40763 1/20 0.36
TOP1 P11387 2/20 0.35
CNR1 P21554 1/20 0.34
CNR2 P34972 1/20 0.34
KMT2A Q03164 5/20 0.34
KDM4E B2RXH2 3/20 0.34
MEN1 O00255 2/20 0.34
MAPT P10636 2/20 0.34
LMNA P02545 1/20 0.34
TYMS P04818 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33
ADRB2 P07550 1/20 0.32
HPGD P15428 1/20 0.32
CYP2C19 P33261 1/20 0.32
TOP2A P11388 1/20 0.31
TOP2B Q02880 1/20 0.31
HTT P42858 1/20 0.30
TNF P01375 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
SCHEMBL9560596 0.93 KDM4E (0.38) STAT3TOP1CNR1CNR2KMT2A
SCHEMBL9510131 0.93 TOP1 (0.36) STAT3TOP1CNR1CNR2KMT2A
SCHEMBL9560110 0.92 SMN1; SMN2 (0.36) STAT3TOP1CNR1CNR2KMT2A
SCHEMBL9512987 0.86 STAT3 (0.39) STAT3TOP1CNR1CNR2KMT2A
SCHEMBL9560141 0.85 STAT3 (0.39) STAT3TOP1CNR1CNR2KMT2A
SCHEMBL9560529 0.85 ALDH1A1 (0.38) STAT3KMT2AMEN1MAPTTYMS
SCHEMBL9569159 0.84 STAT3 (0.41) STAT3TOP1CNR1CNR2KMT2A
SCHEMBL9560567 0.83 STAT3 (0.37) STAT3TOP1CNR1CNR2KMT2A
SCHEMBL9560518 0.83 STAT3 (0.37) STAT3TOP1CNR1CNR2KMT2A
SCHEMBL9569148 0.81 STAT3 (0.38) STAT3TOP1CNR1CNR2KMT2A

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-0563732-A1 7-oxo-7H-pyrido(1,2,3-de)(1,4)benzoxazinecarboxylic acids and esters and their use as antiviral agents BAYER AG (DE) 1993-10-06 EP disclosed