SCHEMBL9569145

SCHEMBL9569145

CCOC(=O)Oc1cn2c3c(c(F)c(F)cc3c1=O)OC(C(C)(C)CCCOc1ccccc1)=C2

nearest known ligand 0.33

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
MEN1 O00255 2/20 0.31
KMT2A Q03164 2/20 0.31
STAT3 P40763 1/20 0.31
KDM4E B2RXH2 1/20 0.31
CRHBP P24387 1/20 0.31
CRHR2 Q13324 1/20 0.31
PPARA Q07869 1/20 0.31
NPC1 O15118 2/20 0.30
RAB9A P51151 2/20 0.30
SMN1; SMN2 Q16637 2/20 0.30
GAA P10253 1/20 0.30
MAPT P10636 1/20 0.30
LMNA P02545 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
SCHEMBL9569190 0.91 TOP1 (0.33) TOP1PPARA
SCHEMBL9569188 0.86 TOP1 (0.41) TOP1KDM4EPPARALMNA
SCHEMBL9560567 0.84 STAT3 (0.37) TOP1MEN1KMT2ASTAT3KDM4E
SCHEMBL9510131 0.80 TOP1 (0.36) TOP1MEN1KMT2ASTAT3KDM4E
SCHEMBL9569179 0.79 TOP2A (0.47) TOP1MEN1KMT2AKDM4ESMN1; SMN2
SCHEMBL9512987 0.78 STAT3 (0.39) TOP1MEN1KMT2ASTAT3KDM4E
SCHEMBL9560141 0.77 STAT3 (0.39) TOP1MEN1KMT2ASTAT3KDM4E
SCHEMBL9569186 0.76 KDM4E (0.43) TOP1TDP1KDM4E
SCHEMBL9569159 0.76 STAT3 (0.41) TOP1MEN1KMT2ASTAT3KDM4E
SCHEMBL9560451 0.75 STAT3 (0.36) TOP1MEN1KMT2ASTAT3KDM4E

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