SCHEMBL4392686

SCHEMBL4392686

O=C(O)C(S)c1ccc(Cl)s1

nearest known ligand 0.49

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GABBR2 O75899 1/20 0.49
GABBR1 Q9UBS5 1/20 0.49
DAO P14920 3/20 0.45
F2 P00734 1/20 0.41
GSK3B P49841 1/20 0.37
PPARA Q07869 1/20 0.36
WRN Q14191 1/20 0.36
ALDH1A1 P00352 2/20 0.33
HPGD P15428 1/20 0.33
TOP2A P11388 1/20 0.33
TOP2B Q02880 1/20 0.33
TSHR P16473 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GAA P10253 1/20 0.32

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
SCHEMBL23972469 0.78 GABBR2 (0.50) GABBR2GABBR1DAOF2GSK3B
SCHEMBL27484445 0.76 CYP2C9 (0.53) GABBR2GABBR1DAOF2GSK3B
SCHEMBL5212433 0.76 GABBR2 (0.53) GABBR2GABBR1DAOF2GSK3B
SCHEMBL16795944 0.74 GABBR2 (0.47) GABBR2GABBR1DAOF2GSK3B
SCHEMBL909126 0.72 GABBR2 (0.49) GABBR2GABBR1DAOF2GSK3B
SCHEMBL11560650 0.72 GABBR2 (0.49) GABBR2GABBR1DAOF2GSK3B
SCHEMBL11560654 0.72 GABBR2 (0.49) GABBR2GABBR1DAOF2GSK3B
SCHEMBL27691026 0.69 GABBR2 (0.46) GABBR2GABBR1DAOF2GSK3B
SCHEMBL8471826 0.69 ALDH1A1 (0.42) GABBR2GABBR1DAOF2GSK3B
SCHEMBL7996347 0.69

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7612075-B2 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2009-11-03 US disclosed
US-20040102450-A1 Substituted oxoazaheterocyclyl compounds AVENTIS PHARMACEUTICALS INC. (US) 2004-05-27 US disclosed
EP-1051176-A4 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARM PROD INC (US) 2002-06-12 EP disclosed
EP-1208097-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS Aventis Pharmaceuticals Inc. (US) 2002-05-29 EP disclosed
WO-2001007436-A2 SUBSTITUTED OXOAZAHETEROCYCLYL COMPOUNDS AVENTIS PHARMACEUTICALS INC. (US) 2001-02-01 WO disclosed
EP-1051176-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS Aventis Pharmaceuticals Products Inc. (US) 2000-11-15 EP disclosed
WO-2000032590-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 2000-06-08 WO disclosed
WO-1999037304-A1 SUBSTITUTED OXOAZAHETEROCYCLYL FACTOR Xa INHIBITORS AVENTIS PHARMACEUTICALS PRODUCTS INC. (US) 1999-07-29 WO disclosed
US-4058619-A Thiophene derivatives having antilipolytic activity SCHERING AKTIENGESELLSCHAFT (DT) 1977-11-15 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-20040102450-A1 Substituted oxoazaheterocyclyl compounds F13B, F9, F11 GABBR2 1644/4885GABBR1 2903/4885DAO 330/4885

“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.