SCHEMBL2828841

SCHEMBL2828841

CCOC(=O)c1ccc(NC(=O)c2cccc(NS(=O)(=O)c3ccccc3OC)c2)cc1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.60
HPGD P15428 2/20 0.60
MAPT P10636 9/20 0.57
SMN1; SMN2 Q16637 4/20 0.57
GAA P10253 2/20 0.57
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
ALDH1A1 P00352 3/20 0.55
MAPK1 P28482 2/20 0.55
CYP1A2 P05177 1/20 0.52
CYP3A4 P08684 1/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
MEN1 O00255 4/20 0.51
KMT2A Q03164 4/20 0.51
L3MBTL1 Q9Y468 1/20 0.51
POLB P06746 1/20 0.51
KDM4E B2RXH2 1/20 0.51
APOBEC3G Q9HC16 1/20 0.51
CPT1A P50416 1/20 0.51

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
SCHEMBL2828881 0.89 CPT1A (0.65) LMNAHPGDMAPTSMN1; SMN2ALDH1A1
SCHEMBL2825815 0.87 SMN1; SMN2 (0.58) LMNAMAPTSMN1; SMN2GAANPC1
SCHEMBL30600092 0.87 MAPT (0.66) LMNAMAPTNPC1RAB9AALDH1A1
SCHEMBL2828149 0.87 MAPT (0.66) LMNAMAPTNPC1RAB9AALDH1A1
SCHEMBL2827825 0.85 SMN1; SMN2 (0.71) LMNAMAPTSMN1; SMN2GAANPC1
SCHEMBL2826756 0.83 SMN1; SMN2 (0.69) LMNAHPGDMAPTSMN1; SMN2GAA
SCHEMBL2825284 0.82 LMNA (0.63) LMNAHPGDMAPTSMN1; SMN2GAA
SCHEMBL2824645 0.80 AR (0.67) LMNAMAPTSMN1; SMN2GAANPC1
SCHEMBL2826890 0.80 SMN1; SMN2 (0.64) LMNAMAPTSMN1; SMN2GAANPC1
SCHEMBL2828894 0.79 SMN1; SMN2 (0.63) LMNAMAPTSMN1; SMN2GAANPC1

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-20120232104-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS BLEICHER KONRAD (DE) 2012-09-13 US disclosed
US-20110319438-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS BLEICHER KONRAD (DE) 2011-12-29 US disclosed
US-20100144762-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS BLEICHER KONRAD 2010-06-10 US disclosed
US-7723538-B2 enzyme inhibitors of membrane-bound carnitine-dependent palmitoyltransferases (CPTs); inhibit gluconeogenesis and therefore counteract hyperglycemia; 4-(3-Benzenesulfonylamino-benzoylamino)-benzoic acid HOFFMANN-LA ROCHE INC. (US) 2010-05-25 US disclosed
EP-1891001-B1 SULFONAMIDE DERIVATIVES USEFUL AS LIVER CARNITINE PALMITOYL TRANSFERASE (L-CPTl) INHIBITORS HOFFMANN LA ROCHE (CH) 2010-05-05 EP disclosed
EP-1891001-A1 SULFONAMIDE DERIVATIVES USEFUL AS LIVER CARNITINE PALMITOYL TRANSFERASE (L-CPTl) INHIBITORS F. Hoffmann-Roche AG (CH) 2008-02-27 EP disclosed
WO-2006131452-A1 SULFONAMIDE DERIVATIVES USEFUL AS LIVER CARNITINE PALMITOYL TRANSFERASE (L-CPTl) INHIBITORS F. HOFFMANN-LA ROCHE AG (CH) 2006-12-14 WO disclosed
US-20060276494-A1 Novel sulfonamides as L-CPT1 inhibitors F. HOFFMANN-LA ROCHE AG (CH) 2006-12-07 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 (4 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-20060276494-A1 Novel sulfonamides as L-CPT1 inhibitors CPT1A, CPT1B, CPT2 LMNA 3524/4885HPGD 1616/4885MAPT 2667/4885
US-20120232104-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 LMNA 3524/4885HPGD 1616/4885MAPT 2667/4885
US-20100144762-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 LMNA 3524/4885HPGD 1616/4885MAPT 2667/4885
US-20110319438-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 LMNA 3524/4885HPGD 1616/4885MAPT 2667/4885

“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.