SCHEMBL7843532

SCHEMBL7843532

CCOC(=O)c1cn(C2CC2)c2c(F)c(Cl)ncc2c1=O

nearest known ligand 0.69

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ADRB2 P07550 1/20 0.54
TOP2A P11388 7/20 0.43
TOP2B Q02880 7/20 0.43
STAT3 P40763 2/20 0.41
TSHR P16473 1/20 0.39
CASP1 P29466 1/20 0.39
KDM4E B2RXH2 1/20 0.38
HPGD P15428 1/20 0.38
CYP2C19 P33261 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
ELANE P08246 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
SCHEMBL8692136 0.89 ADRB2 (0.47) ADRB2TOP2ATOP2BSTAT3KDM4E
SCHEMBL7503528 0.86 ADRB2 (0.40) ADRB2TOP2ATOP2B
SCHEMBL12836412 0.84 ADRB2 (0.49) ADRB2TOP2ATOP2BSTAT3TSHR
SCHEMBL12836620 0.84 ADRB2 (0.50) ADRB2TOP2ATOP2BSTAT3TSHR
SCHEMBL12836413 0.84 ADRB2 (0.48) ADRB2TOP2ATOP2BSTAT3TSHR
SCHEMBL7841318 0.83 TOP2A (0.55) TOP2ATOP2BKDM4EHPGDPOLB
SCHEMBL8435344 0.83 ADRB2 (0.60) ADRB2TOP2ATOP2BSTAT3POLB
SCHEMBL5704396 0.82 ADRB2 (0.64) ADRB2TOP2ATOP2BSTAT3KDM4E
SCHEMBL2844967 0.81 ADRB2 (0.68) ADRB2TOP2ATOP2BSTAT3KDM4E
SCHEMBL29492858 0.81 ADRB2 (0.68) ADRB2TOP2ATOP2BSTAT3KDM4E

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-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 ADRB2 2223/4885TOP2A 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.