SCHEMBL2586166

SCHEMBL2586166

CC(C)(C)OC(=O)CNC(C)(Cl)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.35
GAA P10253 1/20 0.35
KMT2A Q03164 1/20 0.35
CA12 O43570 1/20 0.34
CA2 P00918 1/20 0.34
CA14 Q9ULX7 1/20 0.34
PTPRC P08575 2/20 0.33
CTSS P25774 2/20 0.33
CTSK P43235 2/20 0.33
CYP2D6 P10635 1/20 0.33
DGAT1 O75907 1/20 0.32
MAPT P10636 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TDP1 Q9NUW8 1/20 0.30

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
SCHEMBL756932 0.77 CA2 (0.39) MEN1GAAKMT2ACA12CA2
SCHEMBL10209059 0.73 CA2 (0.39) MEN1GAAKMT2ACA12CA2
SCHEMBL6937980 0.73 MEN1 (0.40) MEN1GAAKMT2ACA12CA2
SCHEMBL21564883 0.72 CA2 (0.36) MEN1GAAKMT2ACA12CA2
SCHEMBL23894059 0.72 CA2 (0.41) MEN1GAAKMT2ACA12CA2
SCHEMBL783009 0.72 CA2 (0.41) MEN1GAAKMT2ACA12CA2
SCHEMBL27485689 0.71 TSHR (0.36) MEN1GAAKMT2ACA12CA2
SCHEMBL7428244 0.71 DGAT1 (0.47) MEN1GAAKMT2ACA12CA2
SCHEMBL3249192 0.71 CA12 (0.35) MEN1GAAKMT2ACA12CA2
SCHEMBL6097359 0.71 CA2 (0.35) MEN1GAAKMT2ACA12CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-RE45108-E1 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2014-09-02 US disclosed
US-8592593-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2013-11-26 US disclosed
US-8304546-B2 Quinolone compound and pharmaceutical composition OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2012-11-06 US disclosed
US-20110269705-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION OTSUKA PHARMACEUTICAL CO., LTD. (JP) 2011-11-03 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 (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-20110269705-A1 QUINOLONE COMPOUND AND PHARMACEUTICAL COMPOSITION PARK7, SNCA, LRRK2 MEN1 3673/4885GAA 2453/4885KMT2A 1992/4885

“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.