SCHEMBL9023587

SCHEMBL9023587

Cc1c(N2CC(N)C3(CC3)C2)c(F)c(N)c2c(=O)c(OC(=O)O)cn(C3CC3)c12

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 3/20 0.44
POLB P06746 2/20 0.44
CACNA1F O60840 1/20 0.44
MAPK1 P28482 1/20 0.44
CACNA1D Q01668 1/20 0.44
CACNA1S Q13698 1/20 0.44
CACNA1C Q13936 1/20 0.44
TOP2A P11388 1/20 0.38
TOP2B Q02880 1/20 0.38
GSK3B P49841 12/20 0.38
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
ALDH1A1 P00352 1/20 0.34
CHRM2 P08172 1/20 0.34
CHRM1 P11229 1/20 0.34
OPRM1 P35372 1/20 0.34
OPRD1 P41143 1/20 0.34

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
SCHEMBL1857357 1.00 KCNH2 (0.44) KCNH2POLBCACNA1FMAPK1CACNA1D
Olamufloxacin SCHEMBL31162720 0.87 KCNH2 (0.59) KCNH2POLBCACNA1FMAPK1CACNA1D
Olamufloxacin SCHEMBL1851976 0.87 KCNH2 (0.59) KCNH2POLBCACNA1FMAPK1CACNA1D
Olamufloxacin SCHEMBL7043166 0.87 KCNH2 (0.59) KCNH2POLBCACNA1FMAPK1CACNA1D
SCHEMBL12646631 0.86 KCNH2 (0.43) KCNH2POLBCACNA1FMAPK1CACNA1D
SCHEMBL9023245 0.85 POLB (0.48) KCNH2POLBCACNA1FMAPK1CACNA1D
SCHEMBL9524296 0.84 KCNH2 (0.52) KCNH2POLBTOP2ATOP2BMEN1
SCHEMBL9023000 0.83 KCNH2 (0.50) KCNH2POLBCACNA1FMAPK1CACNA1D
Olamufloxacin SCHEMBL29711354 0.83 KCNH2 (0.55) KCNH2POLBCACNA1FMAPK1CACNA1D
SCHEMBL9523391 0.82 KCNH2 (0.45) KCNH2POLBTOP2ATOP2BMEN1

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-0641793-B1 5-Amino-8-methyl-7-pyrrolidinylquinoline-3-carboxylic acid derivative HOKURIKU PHARMACEUTICAL (JP) 1996-10-23 EP claimed