SCHEMBL12867174

SCHEMBL12867174

CCOC(=O)C1=CC2C[C@@H]2[C@H](C)C1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.37
KDM4E B2RXH2 3/20 0.37
TSHR P16473 1/20 0.36
MEN1 O00255 2/20 0.35
CYP3A4 P08684 2/20 0.35
KMT2A Q03164 2/20 0.35
CASP1 P29466 1/20 0.35
CA12 O43570 3/20 0.34
CA1 P00915 3/20 0.34
CA2 P00918 3/20 0.34
CA7 P43166 3/20 0.34
CA9 Q16790 3/20 0.34
CA14 Q9ULX7 3/20 0.34
ESR1 P03372 1/20 0.34
ESR2 Q92731 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34
RELA Q04206 1/20 0.34
GLA P06280 1/20 0.34
CYP1A2 P05177 2/20 0.33

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
SCHEMBL15929807 1.00 LMNA (0.37) LMNAKDM4ETSHRMEN1CYP3A4
SCHEMBL10478110 0.78 LMNA (0.44) LMNAKDM4ETSHRMEN1CYP3A4
SCHEMBL17145151 0.77 MAOB (0.39) LMNATSHRMEN1CYP3A4KMT2A
SCHEMBL12867184 0.75 LMNA (0.40) LMNAKDM4ETSHRMEN1CYP3A4
SCHEMBL12867186 0.75 LMNA (0.40) LMNAKDM4ETSHRMEN1CYP3A4
SCHEMBL16646267 0.75 LMNA (0.37) LMNAKDM4ETSHRMEN1CYP3A4
SCHEMBL17145154 0.74 LMNA (0.37) LMNAKDM4ETSHRMEN1CYP3A4
SCHEMBL3455790 0.73 LMNA (0.44) LMNAKDM4ETSHRMEN1CYP3A4
SCHEMBL22434843 0.72 TSHR (0.39) LMNAKDM4ETSHRMEN1CYP3A4
SCHEMBL14283139 0.72 KMT2A (0.41) LMNAKDM4ETSHRCYP3A4KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110040120-A1 PREPARATION OF OSELTAMIVIR PHOSPHATE (TAMIFLU®) AND INTERMEDIATES STARTING FROM D-GLUCOSE OR D-XYLOSE APOTEX PHARMACHEM INC. (CA) 2011-02-17 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-20110040120-A1 PREPARATION OF OSELTAMIVIR PHOSPHATE (TAMIFLU®) AND INTERMEDIATES STARTING FROM D-GLUCOSE OR D-XYLOSE G6PD, GALE, MGAM LMNA 3190/4885KDM4E 1139/4885TSHR 3476/4885

“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.