SCHEMBL13585809

SCHEMBL13585809

CCc1c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c2c1CC

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TOP2A P11388 6/20 0.58
TOP2B Q02880 6/20 0.58
KCNH2 Q12809 5/20 0.57
ALDH1A1 P00352 4/20 0.54
KDM4E B2RXH2 3/20 0.54
HPGD P15428 2/20 0.54
HSD17B10 Q99714 2/20 0.54
LMNA P02545 1/20 0.54
MAPT P10636 1/20 0.54
POLB P06746 2/20 0.53
OPRM1 P35372 2/20 0.53
CHRM2 P08172 1/20 0.53
CHRM1 P11229 1/20 0.53
OPRD1 P41143 1/20 0.53
GSK3B P49841 1/20 0.52
PRKD3 O94806 1/20 0.51
ALOX15 P16050 1/20 0.51
CLK2 P49760 1/20 0.51
CLK4 Q9HAZ1 1/20 0.51
TDP1 Q9NUW8 1/20 0.51

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
SCHEMBL6645463 0.92 TOP2A (0.60) TOP2ATOP2BKCNH2ALDH1A1KDM4E
SCHEMBL14143614 0.91 KCNH2 (0.63) TOP2ATOP2BKCNH2ALDH1A1KDM4E
SCHEMBL13581382 0.88 KCNH2 (0.55) TOP2ATOP2BKCNH2ALDH1A1KDM4E
SCHEMBL14143613 0.88 KCNH2 (0.62) TOP2ATOP2BKCNH2ALDH1A1KDM4E
SCHEMBL10571331 0.84 KDM4E (0.60) TOP2ATOP2BKCNH2ALDH1A1KDM4E
SCHEMBL4369417 0.84 LMNA (0.63) TOP2ATOP2BKCNH2ALDH1A1KDM4E
SCHEMBL4368116 0.83 ALDH1A1 (0.66) TOP2ATOP2BKCNH2ALDH1A1KDM4E
SCHEMBL3400695 0.83 TOP2A (0.61) TOP2ATOP2BKCNH2ALDH1A1KDM4E
SCHEMBL10470855 0.82 TOP2A (0.63) TOP2ATOP2BKCNH2ALDH1A1KDM4E
SCHEMBL10572826 0.82 ALDH1A1 (0.75) TOP2ATOP2BKCNH2ALDH1A1KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7626032-B2 Generation triple-targeting, chiral, broad-spectrum antimicrobial 7-substituted piperidino-quinolone carboxylic acid derivatives, their preparation, compositions and use as medicaments WOCKHARDT LIMITED (IN) 2009-12-01 US disclosed
US-20080214608-A1 New generation triple-targeting, chiral, broad-spectrum antimicrobial 7-substituted piperidino-quinolone carboxylic acid derivatives, their preparation, compositions and use as medicaments WOCKHARDT LIMITED 2008-09-04 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20080214608-A1 New generation triple-targeting, chiral, broad-spectrum antimicrobial 7-substituted piperidino-quinolone carboxylic acid derivatives, their preparation, compositions and use as medicaments ABCG2, CYP3A7, UGT1A7 TOP2A 292/4885TOP2B 815/4885KCNH2 4327/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.