SCHEMBL2824428

SCHEMBL2824428

CCOC(=O)c1ccc(NC(=O)c2ccc(Cl)c(NS(=O)(=O)c3cc(Cl)ccc3OC)c2)cc1

nearest known ligand 0.62

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 6/20 0.62
CPT2 P23786 3/20 0.62
CPT1B Q92523 4/20 0.61
LMNA P02545 4/20 0.59
HPGD P15428 2/20 0.59
ALDH1A1 P00352 4/20 0.55
KMT2A Q03164 2/20 0.55
MEN1 O00255 1/20 0.55
MAPT P10636 4/20 0.54
KDM4E B2RXH2 2/20 0.54
MAPK1 P28482 1/20 0.54
ALPL P05186 2/20 0.52
HTT P42858 2/20 0.51
NPSR1 Q6W5P4 1/20 0.51
WDR5 P61964 1/20 0.49

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
SCHEMBL3556431 0.92 LMNA (0.58) CPT1ACPT2CPT1BLMNAHPGD
SCHEMBL2825347 0.92 LMNA (0.59) CPT1ACPT2CPT1BLMNAHPGD
SCHEMBL2827310 0.89 CPT1A (0.79) CPT1ACPT2CPT1BLMNAHPGD
SCHEMBL2824229 0.88 CPT1A (0.79) CPT1ACPT2CPT1BALDH1A1KMT2A
SCHEMBL2828881 0.87 CPT1A (0.65) CPT1ACPT2CPT1BLMNAHPGD
SCHEMBL2825880 0.87 CPT1A (0.69) CPT1ACPT2CPT1BLMNAHPGD
SCHEMBL12971607 0.85 LMNA (0.79) CPT1ACPT1BLMNAHPGDALDH1A1
SCHEMBL2825246 0.83 CPT2 (0.72) CPT1ACPT2CPT1BLMNAALDH1A1
SCHEMBL2825285 0.82 LMNA (0.62) CPT1ACPT2CPT1BLMNAALDH1A1
SCHEMBL2825316 0.81 LMNA (0.72) CPT1ACPT2CPT1BLMNAHPGD

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 CPT1A 1/4885CPT2 3/4885CPT1B 2/4885
US-20120232104-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 CPT1A 1/4885CPT2 3/4885CPT1B 2/4885
US-20100144762-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 CPT1A 1/4885CPT2 3/4885CPT1B 2/4885
US-20110319438-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 CPT1A 1/4885CPT2 3/4885CPT1B 2/4885

“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.