SCHEMBL7496259

SCHEMBL7496259

NC(=O)NCC12CN(c3c(F)cc4c(=O)c(C(=O)O)cn(C5CC5)c4c3F)CC1CCO2

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.51
TOP2A P11388 5/20 0.47
TOP2B Q02880 5/20 0.47
ALDH1A1 P00352 5/20 0.47
POLB P06746 3/20 0.47
OPRM1 P35372 2/20 0.47
CHRM2 P08172 1/20 0.47
CHRM1 P11229 1/20 0.47
OPRD1 P41143 1/20 0.47
KDM4E B2RXH2 4/20 0.44
HPGD P15428 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
HSD17B10 Q99714 2/20 0.44
PRKD3 O94806 1/20 0.44
ALOX15 P16050 1/20 0.44
CLK2 P49760 1/20 0.44
CLK4 Q9HAZ1 1/20 0.44
LMNA P02545 2/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MEN1 O00255 1/20 0.42

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
SCHEMBL7499638 0.92 ALDH1A1 (0.57) KCNH2TOP2ATOP2BALDH1A1POLB
SCHEMBL7496263 0.90 KCNH2 (0.40) KCNH2TOP2ATOP2BALDH1A1POLB
SCHEMBL7495691 0.90 KCNH2 (0.58) KCNH2TOP2ATOP2BALDH1A1POLB
Hydrochloric Acid SCHEMBL7845648 0.89 KCNH2 (0.51) KCNH2TOP2ATOP2BALDH1A1POLB
SCHEMBL7497795 0.89 KCNH2 (0.49) KCNH2TOP2ATOP2BALDH1A1POLB
SCHEMBL7495783 0.89 KCNH2 (0.48) KCNH2ALDH1A1POLBOPRM1CHRM2
SCHEMBL7846922 0.89 KCNH2 (0.46) KCNH2TOP2ATOP2BALDH1A1POLB
SCHEMBL7836509 0.89 KCNH2 (0.46) KCNH2TOP2ATOP2BALDH1A1POLB
SCHEMBL7836504 0.89 KCNH2 (0.46) KCNH2TOP2ATOP2BALDH1A1POLB
SCHEMBL7494366 0.89 KCNH2 (0.46) KCNH2TOP2ATOP2BALDH1A1POLB

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-0944385-B1 USE OF 7-(1-AMINOMETHYL-2-OXA-7-AZA-BICYCLO 3.3.0]OCT-7-YL)-QUINOLONE CARBOXYLIC ACID AND NAPHTHYRIDONE CARBOXYLIC ACID DERIVATIVES FOR TREATING HELICOBACTER PYLORI INFECTIONS AND THE GASTRODUODENAL DISEASES ASSOCIATED THEREWITH BAYER AG (DE) 2002-10-16 EP disclosed
US-20010036941-A1 Use of 7-(1-aminomethyl-2-oxa-7-aza-bicyclo[3.3.0]oct-7-yl)-quinolonecarboxylic acid and -naphthyridonecarboxylic acid derivatives for the therapy of Helicobacter pylori infections and associated gastroduodenal disorders PETERSEN UWE (DE) 2001-11-01 US disclosed
US-6288081-B1 Use of 7-(1-aminomethyl-2-oxa-7-aza-bicyclo[3.3.0]oct-7-yl)-quinolone carboxylic acid and naphthyridone carboxylic acid derivatives for treating Helicobacter pylori infections and the gastroduodenal diseases associated therewith BAYER AKTIENGESELLSCHAFT (DE) 2001-09-11 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-20010036941-A1 Use of 7-(1-aminomethyl-2-oxa-7-aza-bicyclo[3.3.0]oct-7-yl)-quinolonecarboxylic acid and -naphthyridonecarboxylic acid derivatives for the therapy of Helicobacter pylori infections and associated gastroduodenal disorders OXER1, AOC3, PAM KCNH2 3936/4885TOP2A 156/4885TOP2B 177/4885

“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.