SCHEMBL3302816

SCHEMBL3302816

Cc1c[nH]c2ccc(N(C(C(=O)O)C(C)(C)C)S(=O)(=O)c3cc(Cl)cc(Cl)c3)cc12

nearest known ligand 0.37

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.35
GAA P10253 1/20 0.35
SI P14410 1/20 0.35
MGAM2 Q2M2H8 1/20 0.35
POLB P06746 1/20 0.33
DUSP3 P51452 1/20 0.33
PTPN5 P54829 1/20 0.33
PTPN11 Q06124 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
NR3C1 P04150 1/20 0.33
HSD11B1 P28845 1/20 0.33
F7 P08709 1/20 0.33
F3 P13726 1/20 0.33
HTR6 P50406 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
SCHEMBL3297160 0.91 MGAM (0.34) MGAMGAASIMGAM2POLB
SCHEMBL3298532 0.89 MGAM (0.33) MGAMGAASIMGAM2POLB
SCHEMBL3300940 0.88 HTR6 (0.41) HSD17B10NR3C1HTR6
SCHEMBL3303945 0.87 MMP7 (0.35) MGAMGAASIMGAM2HPGD
SCHEMBL3299934 0.87 IMPDH2 (0.34) MGAMGAASIMGAM2HPGD
SCHEMBL3299041 0.84 KDM4E (0.39) POLBHPGDHSD11B1
SCHEMBL3301653 0.83 ALDH1A1 (0.36) POLBHSD11B1
SCHEMBL3300480 0.82 PTGS2 (0.37) HSD11B1F7F3
SCHEMBL3305698 0.81 PTGS2 (0.38) GAAHSD11B1F7F3
SCHEMBL3299972 0.78 PTGS2 (0.34) HSD11B1F7F3

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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2010-04-15 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-20100093703-A1 SUBSTITUTED ARYLSULPHONYLGLYCINES, THE PREPARATION THEREOF AND THE USE THEREOF AS PHARMACEUTICAL COMPOSITIONS PYGL, PYGM, G6PC1 MGAM 55/4885GAA 67/4885SI 354/4885

“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.