SCHEMBL14353449

SCHEMBL14353449

CCCOc1ccc(F)c2c(=O)c(-c3ccc(OC)cc3)cn(CCNC(=O)C(CCCCNC(=O)O)NC(=O)OC(C)(C)C)c12

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 13/20 0.37
PTPN22 Q9Y2R2 2/20 0.37
CXCR3 P49682 1/20 0.36
AKT1 P31749 1/20 0.34
MMP2 P08253 1/20 0.34
MMP9 P14780 1/20 0.34
PSMB8 P28062 1/20 0.34
PSMB9 P28065 1/20 0.34
PSMB5 P28074 1/20 0.34

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
SCHEMBL14353446 1.00 PTPN1 (0.37) PTPN1PTPN22CXCR3AKT1MMP2
SCHEMBL12175972 0.96 PTPN1 (0.36) PTPN1PTPN22CXCR3PSMB8PSMB9
SCHEMBL15986399 0.96 PTPN1 (0.36) PTPN1PTPN22CXCR3PSMB8PSMB9
SCHEMBL2584858 0.91 PTPN1 (0.33) PTPN1PTPN22CXCR3AKT1MMP2
SCHEMBL2584855 0.91 PTPN1 (0.33) PTPN1PTPN22CXCR3AKT1MMP2
SCHEMBL12175886 0.91 SCN9A (0.36) PTPN1PTPN22AKT1
SCHEMBL2461031 0.88 MMP2 (0.33) PTPN1PTPN22CXCR3AKT1MMP2
SCHEMBL2488543 0.87 SUCNR1 (0.36)
SCHEMBL14479942 0.86 CCKBR (0.36) PTPN1PTPN22AKT1
SCHEMBL14353494 0.85 CHRM1 (0.37) PTPN1

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
EP-2364298-B1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMA CO LTD (JP) 2016-08-03 EP disclosed
US-9018229-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2015-04-28 US disclosed
US-20140045793-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-02-13 US disclosed
US-8592593-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-11-26 US disclosed
US-20130005675-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-01-03 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 (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-20130005675-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 PTPN1 876/4885PTPN22 932/4885CXCR3 475/4885
US-20140045793-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 PTPN1 876/4885PTPN22 932/4885CXCR3 475/4885

“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.