SCHEMBL7046482

SCHEMBL7046482

CC(=O)Nc1c(F)c(F)c(C)c2c1c(=O)c(C(=O)O)cn2C1CC1F

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 10/20 0.40
TOP2A P11388 4/20 0.38
TOP2B Q02880 4/20 0.38
MEN1 O00255 1/20 0.37
KMT2A Q03164 1/20 0.37
CYP3A4 P08684 1/20 0.35
KCNH2 Q12809 2/20 0.35
CACNA1F O60840 1/20 0.35
POLB P06746 1/20 0.35
MAPK1 P28482 1/20 0.35
CACNA1D Q01668 1/20 0.35
CACNA1S Q13698 1/20 0.35
CACNA1C Q13936 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
STAT3 P40763 1/20 0.34
KDM4E B2RXH2 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL6878164 1.00 GSK3B (0.40) GSK3BTOP2ATOP2BMEN1KMT2A
SCHEMBL6877382 0.87 GSK3B (0.53) GSK3BTOP2ATOP2BMEN1KMT2A
SCHEMBL5236368 0.82 GSK3B (0.50) GSK3BTOP2ATOP2BMEN1KMT2A
SCHEMBL501142 0.82 GSK3B (0.50) GSK3BTOP2ATOP2BMEN1KMT2A
SCHEMBL7044371 0.81 MEN1 (0.41) GSK3BTOP2ATOP2BMEN1KMT2A
SCHEMBL8007897 0.81 GSK3B (0.45) GSK3BTOP2ATOP2BMEN1KMT2A
SCHEMBL8744082 0.81 GSK3B (0.45) GSK3BTOP2ATOP2BMEN1KMT2A
SCHEMBL7997875 0.81 GSK3B (0.45) GSK3BTOP2ATOP2BMEN1KMT2A
SCHEMBL7510517 0.79 TOP2A (0.38) GSK3BTOP2ATOP2BMEN1KMT2A
SCHEMBL7510524 0.79 TOP2A (0.38) GSK3BTOP2ATOP2BMEN1KMT2A

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-6825353-B2 AN AMINE SUBSTITUENT AT THE 7-POSITION OF THE QUINOLONE-CARBOXYLIC ACID DERIVATIVE IS PRODUCED; BACTERICIDES DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2004-11-30 US disclosed
US-20030060631-A1 Process for producing quinolonecarboxlic acids and intermediates thereof DAIICHI PHARMACEUTICAL CO., LTD. (JP) 2003-03-27 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-20030060631-A1 Process for producing quinolonecarboxlic acids and intermediates thereof NQO2, QPCT, QARS1 GSK3B 1080/4885TOP2A 747/4885TOP2B 785/4885

“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.