SCHEMBL13166192

SCHEMBL13166192

CCOC(=O)N1CCc2c(sc(NC(=O)/C=C/c3cccc(O)c3)c2C#N)C1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.55
MAPT P10636 6/20 0.55
KDM4E B2RXH2 4/20 0.55
GAA P10253 3/20 0.55
MEN1 O00255 9/20 0.54
KMT2A Q03164 9/20 0.54
ALDH1A1 P00352 8/20 0.54
HSD17B10 Q99714 3/20 0.54
SMN1; SMN2 Q16637 3/20 0.54
LMNA P02545 2/20 0.54
NPSR1 Q6W5P4 2/20 0.54
TP53 P04637 1/20 0.54
TSHR P16473 1/20 0.54
TGFBR1 P36897 1/20 0.51
HPGD P15428 2/20 0.49
ALOX15 P16050 1/20 0.49
POLB P06746 2/20 0.49
GRM1 Q13255 1/20 0.46
ADORA3 P0DMS8 1/20 0.45
PDE4D Q08499 1/20 0.45

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
SCHEMBL3355782 1.00 L3MBTL1 (0.55) L3MBTL1MAPTKDM4EGAAMEN1
SCHEMBL3357091 0.93 L3MBTL1 (0.55) L3MBTL1MAPTKDM4EGAAMEN1
SCHEMBL13166074 0.93 L3MBTL1 (0.55) L3MBTL1MAPTKDM4EGAAMEN1
SCHEMBL3356495 0.92 L3MBTL1 (0.54) L3MBTL1MAPTKDM4EGAAMEN1
SCHEMBL13166067 0.92 L3MBTL1 (0.54) L3MBTL1MAPTKDM4EGAAMEN1
SCHEMBL13166080 0.92 L3MBTL1 (0.54) L3MBTL1MAPTKDM4EGAAMEN1
SCHEMBL3357995 0.92 L3MBTL1 (0.54) L3MBTL1MAPTKDM4EGAAMEN1
SCHEMBL3353184 0.92 L3MBTL1 (0.59) L3MBTL1MAPTKDM4EGAAMEN1
SCHEMBL3353182 0.92 L3MBTL1 (0.59) L3MBTL1MAPTKDM4EGAAMEN1
SCHEMBL13166028 0.92 L3MBTL1 (0.59) L3MBTL1MAPTKDM4EGAAMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7803945-B2 Tetrahydropyridothiophenes 4SC AG (DE) 2010-09-28 US disclosed
US-7803945-B2 Tetrahydropyridothiophenes 4SC AG (DE) 2010-09-28 US disclosed
US-7723523-B2 Tetrahydropyridothiophenes 4SC AG (DE) 2010-05-25 US disclosed
US-7723523-B2 Tetrahydropyridothiophenes 4SC AG (DE) 2010-05-25 US disclosed
US-20090270378-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES NYCOMED GMBH (DE) 2009-10-29 US disclosed
US-20090270378-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES NYCOMED GMBH (DE) 2009-10-29 US disclosed
US-20070244112-A1 Novel tetrahydropyridothiophenes ALTANA PHARMA AG (DE) 2007-10-18 US disclosed
US-20070244112-A1 Novel tetrahydropyridothiophenes ALTANA PHARMA AG (DE) 2007-10-18 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-20090270378-A1 NOVEL TETRAHYDROPYRIDOTHIOPHENES BAX, BCL2, CCAR2 L3MBTL1 2029/4885MAPT 1150/4885KDM4E 1598/4885
US-20070244112-A1 Novel tetrahydropyridothiophenes BAX, BCL2, BAD L3MBTL1 2161/4885MAPT 1192/4885KDM4E 1628/4885

“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.