SCHEMBL9560110

SCHEMBL9560110

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

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.36
STAT3 P40763 1/20 0.35
KMT2A Q03164 7/20 0.34
MEN1 O00255 6/20 0.34
MAPT P10636 5/20 0.34
ALDH1A1 P00352 5/20 0.34
KDM4E B2RXH2 4/20 0.34
LMNA P02545 3/20 0.34
MAPK1 P28482 2/20 0.34
NPSR1 Q6W5P4 1/20 0.34
TOP2A P11388 1/20 0.34
TOP2B Q02880 1/20 0.34
FPR1 P21462 2/20 0.34
HPGD P15428 2/20 0.33
TOP1 P11387 1/20 0.33
TSHR P16473 2/20 0.33
CNR1 P21554 1/20 0.33
CNR2 P34972 1/20 0.33
CRHBP P24387 1/20 0.33
CRHR2 Q13324 1/20 0.33

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
SCHEMBL9560451 0.92 STAT3 (0.36) STAT3KMT2AMEN1MAPTKDM4E
SCHEMBL9560596 0.90 KDM4E (0.38) STAT3KMT2AMEN1MAPTALDH1A1
SCHEMBL9510131 0.90 TOP1 (0.36) STAT3KMT2AMEN1MAPTKDM4E
SCHEMBL9560529 0.86 ALDH1A1 (0.38) STAT3KMT2AMEN1MAPTALDH1A1
SCHEMBL9560141 0.85 STAT3 (0.39) STAT3KMT2AMEN1MAPTALDH1A1
SCHEMBL9512987 0.84 STAT3 (0.39) STAT3KMT2AMEN1MAPTALDH1A1
Hydrochloric Acid SCHEMBL9560156 0.83 TOP1 (0.46) TOP2ATOP2BTOP1
SCHEMBL9569159 0.82 STAT3 (0.41) STAT3KMT2AMEN1MAPTALDH1A1
SCHEMBL9560567 0.81 STAT3 (0.37) STAT3KMT2AMEN1MAPTALDH1A1
SCHEMBL9560518 0.81 STAT3 (0.37) STAT3KMT2AMEN1MAPTALDH1A1

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