SCHEMBL9569192

SCHEMBL9569192

Nc1ncc(C2=Cn3cc(OC(=O)O)c(=O)c4cc(F)c(F)c(c43)O2)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TOP1 P11387 2/20 0.37
CYP3A4 P08684 1/20 0.30
CYP2C9 P11712 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
SCHEMBL9569191 0.88 TOP1 (0.46) TOP1CYP3A4CYP2C9
SCHEMBL9509563 0.81 TOP1 (0.40) TOP1
SCHEMBL9509713 0.76 TOP1 (0.40) TOP1
SCHEMBL9560540 0.74 TOP1 (0.36) TOP1CYP3A4
SCHEMBL9560364 0.73 TOP1 (0.38) TOP1
SCHEMBL9569195 0.73 TOP1 (0.40) TOP1
SCHEMBL9560596 0.71 KDM4E (0.38) TOP1
SCHEMBL9510131 0.70 TOP1 (0.36) TOP1
SCHEMBL9560451 0.69 STAT3 (0.36) TOP1
SCHEMBL9509558 0.68 TOP1 (0.52) 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