SCHEMBL7859489

SCHEMBL7859489

O=C(O)CN1C(=O)/C(=C/c2ccc(-c3ccc(CO)c(Cl)c3)o2)SC1=S

nearest known ligand 0.82

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.72
PTPN22 Q9Y2R2 2/20 0.68
APEX1 P27695 1/20 0.67
MAP3K5 Q99683 3/20 0.66
HIF1AN Q9NWT6 1/20 0.61
EIF4E P06730 1/20 0.60
EIF4G1 Q04637 1/20 0.60
MEN1 O00255 1/20 0.60
ALDH1A1 P00352 1/20 0.60
POLB P06746 1/20 0.60
THRB P10828 1/20 0.60
RECQL P46063 1/20 0.60
KMT2A Q03164 1/20 0.60
MCL1 Q07820 1/20 0.60
NPSR1 Q6W5P4 1/20 0.60
TDP1 Q9NUW8 1/20 0.60

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
SCHEMBL3905933 0.91 MAPT (0.77) MAPTPTPN22APEX1MAP3K5EIF4E
SCHEMBL3904248 0.91 MAPT (0.77) MAPTPTPN22APEX1MAP3K5EIF4E
SCHEMBL7859580 0.91 MAPT (0.77) MAPTPTPN22APEX1MAP3K5EIF4E
SCHEMBL7860584 0.88 MAPT (0.73) MAPTPTPN22APEX1MAP3K5HIF1AN
SCHEMBL12676815 0.85 MAPT (0.70) MAPTPTPN22APEX1MAP3K5HIF1AN
SCHEMBL3899060 0.85 MAPT (0.70) MAPTPTPN22APEX1MAP3K5HIF1AN
SCHEMBL3899067 0.85 MAPT (0.70) MAPTPTPN22APEX1MAP3K5HIF1AN
SCHEMBL3892576 0.85 HIF1AN (0.81) MAPTPTPN22APEX1MAP3K5HIF1AN
SCHEMBL13056328 0.85 HIF1AN (0.81) MAPTPTPN22APEX1MAP3K5HIF1AN
SCHEMBL3892582 0.85 HIF1AN (0.81) MAPTPTPN22APEX1MAP3K5HIF1AN

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-7947717-B2 Inhibitors of lethal factor protease BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2011-05-24 US disclosed
US-20100016292-A1 INHIBITORS OF LETHAL FACTOR PROTEASE THE BURNHAM INSTITUTE (US) 2010-01-21 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-20100016292-A1 INHIBITORS OF LETHAL FACTOR PROTEASE APAF1, F11, SERPINB1 MAPT 2957/4885PTPN22 2193/4885APEX1 2617/4885

“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.