SCHEMBL17494232

SCHEMBL17494232

CCOC(=O)c1cc2cc(F)c(N3CCCC(NC(=O)OC(C)(C)C)C3)c(C)c2n(C2CC2)c1=O

nearest known ligand 0.50

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 6/20 0.49
SCN5A Q14524 1/20 0.49
DPP4 P27487 7/20 0.41
BTK Q06187 2/20 0.40
JAK3 P52333 1/20 0.40
MAP4K4 O95819 2/20 0.38
F10 P00742 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
SCHEMBL17494313 0.95 KCNH2 (0.53) KCNH2SCN5ADPP4
SCHEMBL17494286 0.93 KCNH2 (0.49) KCNH2SCN5ADPP4
SCHEMBL17494378 0.91 SCN5A (0.58) KCNH2SCN5ADPP4BTKJAK3
SCHEMBL17494217 0.86 SCN5A (0.62) KCNH2SCN5ADPP4
SCHEMBL17494427 0.84 KCNH2 (0.53) KCNH2SCN5A
SCHEMBL17494254 0.84 KCNH2 (0.53) KCNH2SCN5A
SCHEMBL17494346 0.84 KCNH2 (0.53) KCNH2SCN5A
SCHEMBL19194738 0.84 KCNH2 (0.56) KCNH2SCN5A
SCHEMBL17494299 0.84 KCNH2 (0.58) KCNH2SCN5A
SCHEMBL17494221 0.83 SCN5A (0.58) KCNH2SCN5ADPP4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10160726-B2 Quinolone derivatives as antibacterials NOVARTIS AG (CH) 2018-12-25 US disclosed
US-20170217897-A1 QUINOLONE DERIVATIVES AS ANTIBACTERIALS WUXI APPTEC (CN) 2017-08-03 US disclosed
US-20170217897-A1 QUINOLONE DERIVATIVES AS ANTIBACTERIALS WUXI APPTEC (CN) 2017-08-03 US disclosed
EP-3177593-A1 QUINOLONE DERIVATIVES AS ANTIBACTERIALS Novartis AG (CH) 2017-06-14 EP disclosed
WO-2016020836-A1 QUINOLONE DERIVATIVES AS ANTIBACTERIALS NOVARTIS AG (CH) 2016-02-11 WO 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 (2 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-20170217897-A1 QUINOLONE DERIVATIVES AS ANTIBACTERIALS TOP1, NQO2, TOP2A KCNH2 3467/4885SCN5A 1288/4885DPP4 734/4885
US-10160726-B2 Quinolone derivatives as antibacterials TOP1, NQO2, TOP2A KCNH2 3467/4885SCN5A 1288/4885DPP4 734/4885

“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.