SCHEMBL7006571

SCHEMBL7006571

Cc1ccc(S(=O)(=O)N2Cc3ccc(-c4c(F)cc5c(=O)c(C(=O)O)cn(C6CC6)c5c4Cl)cc3C2)cc1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 11/20 0.51
TOP2B Q02880 11/20 0.51
ALDH1A1 P00352 2/20 0.45
POLB P06746 1/20 0.45
CHRM2 P08172 1/20 0.45
CHRM1 P11229 1/20 0.45
OPRM1 P35372 1/20 0.45
OPRD1 P41143 1/20 0.45
KDM4E B2RXH2 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
KCNH2 Q12809 3/20 0.40
GSK3B P49841 1/20 0.38

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
SCHEMBL7013315 0.92 TOP2A (0.61) TOP2ATOP2BALDH1A1KDM4ELMNA
SCHEMBL7012172 0.92 TOP2A (0.52) TOP2ATOP2BALDH1A1KDM4ELMNA
SCHEMBL7008129 0.90 ADRB2 (0.44) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL7007624 0.89 TOP2A (0.49) TOP2ATOP2BALDH1A1POLBOPRM1
SCHEMBL7008331 0.88 TOP2A (0.47) TOP2ATOP2BALDH1A1POLBOPRM1
SCHEMBL7014704 0.88 TOP2A (0.49) TOP2ATOP2BALDH1A1POLBOPRM1
SCHEMBL7503095 0.87 HDAC1 (0.40) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL7008936 0.85 TOP2A (0.59) TOP2ATOP2BALDH1A1POLBCHRM2
SCHEMBL7006784 0.84 TOP2A (0.46) TOP2ATOP2BALDH1A1CHRM2KDM4E
SCHEMBL7498452 0.83 TOP2A (0.47) TOP2ATOP2BALDH1A1KDM4ELMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0775702-B1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO LTD (JP) 2003-07-23 EP disclosed
US-5935952-A ANTIBACTERIAL AGENT TOYAMA CHEMICAL CO., LTD. (JP) 1999-08-10 US disclosed
EP-0775702-A1 NOVEL QUINOLONE- OR NAPHTHYRIDONECARBOXYLIC ACID DERIVATIVE OR SALT THEREOF TOYAMA CHEMICAL CO., LTD. (JP) 1997-05-28 EP disclosed