SCHEMBL3299763

SCHEMBL3299763

CC(C)(C)OC(=O)N1CCN(c2ccc(-n3ccc4cc(NS(=O)(=O)c5cc(Cl)cc(Cl)c5)ccc43)nn2)CC1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
STS P08842 4/20 0.46
GPR119 Q8TDV5 2/20 0.43
TGFBR1 P36897 8/20 0.42
HTR6 P50406 1/20 0.41
NR1H2 P55055 1/20 0.38
SUV39H2 Q9H5I1 1/20 0.37
MAP4K4 O95819 1/20 0.37
F13A1 P00488 1/20 0.37
TGM2 P21980 1/20 0.37
TGM1 P22735 1/20 0.37
TGM3 Q08188 1/20 0.37

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
SCHEMBL3302786 0.91 STS (0.45) STSGPR119TGFBR1HTR6F13A1
SCHEMBL3301597 0.91 STS (0.45) STSGPR119TGFBR1HTR6NR1H2
SCHEMBL3301345 0.88 STS (0.43) STSGPR119TGFBR1HTR6SUV39H2
SCHEMBL3302889 0.87 STS (0.41) STSGPR119TGFBR1HTR6NR1H2
SCHEMBL3302638 0.84 STS (0.43) STSGPR119TGFBR1HTR6NR1H2
SCHEMBL3294583 0.82 CKS1B (0.40) STSGPR119SUV39H2F13A1TGM2
SCHEMBL3304139 0.81 GPR119 (0.42) STSGPR119SUV39H2MAP4K4
SCHEMBL3305215 0.81 GPR119 (0.47) STSGPR119TGFBR1HTR6
SCHEMBL3299239 0.78 GPR119 (0.40) STSGPR119SUV39H2MAP4K4
SCHEMBL3297269 0.78 MAP4K4 (0.49) GPR119NR1H2SUV39H2MAP4K4

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
EP-2121600-B1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INT (DE) 2012-07-18 EP disclosed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
US-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 US disclosed
WO-2008099000-A2 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2008-08-21 WO 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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 STS 392/4885GPR119 177/4885TGFBR1 1888/4885

“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.