SCHEMBL2825880

SCHEMBL2825880

CCOC(=O)c1ccc(NC(=O)c2cc(NS(=O)(=O)c3cc(Cl)ccc3Cl)c(OC)c(OC)c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
CPT1A P50416 4/20 0.69
CPT2 P23786 2/20 0.69
ALDH1A1 P00352 7/20 0.51
LMNA P02545 5/20 0.51
MAPT P10636 5/20 0.51
KMT2A Q03164 4/20 0.51
SMN1; SMN2 Q16637 4/20 0.51
MEN1 O00255 3/20 0.51
HTT P42858 3/20 0.51
CPT1B Q92523 2/20 0.50
HPGD P15428 4/20 0.49
KDM4E B2RXH2 3/20 0.49
MAPK1 P28482 2/20 0.49
MITF O75030 1/20 0.48
IKBKB O14920 1/20 0.48
STAT3 P40763 1/20 0.47
PTGDR Q13258 1/20 0.45
PTGDR2 Q9Y5Y4 1/20 0.45

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
SCHEMBL2827310 0.94 CPT1A (0.79) CPT1ACPT2ALDH1A1LMNAMAPT
SCHEMBL2824320 0.88 CPT1A (0.88) CPT1ACPT2ALDH1A1LMNAMAPT
SCHEMBL2827973 0.88 CPT2 (0.56) CPT1ACPT2ALDH1A1LMNAMAPT
SCHEMBL2825172 0.88 CPT2 (0.61) CPT1ACPT2ALDH1A1LMNAMAPT
SCHEMBL2825347 0.87 LMNA (0.59) CPT1ACPT2ALDH1A1LMNAMAPT
SCHEMBL2828139 0.87 CPT2 (0.60) CPT1ACPT2ALDH1A1LMNAMAPT
SCHEMBL2824428 0.87 CPT1A (0.62) CPT1ACPT2ALDH1A1LMNAMAPT
SCHEMBL2825039 0.84 CPT2 (0.58) CPT1ACPT2ALDH1A1LMNAMAPT
SCHEMBL30016496 0.82 CPT1A (1.00) CPT1ACPT2CPT1B
SCHEMBL2824558 0.82 CPT1A (1.00) CPT1ACPT2CPT1B

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 3/4885ALDH1A1 216/4885
US-20120232104-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 CPT1A 1/4885CPT2 3/4885ALDH1A1 216/4885
US-20100144762-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 CPT1A 1/4885CPT2 3/4885ALDH1A1 216/4885
US-20110319438-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 CPT1A 1/4885CPT2 3/4885ALDH1A1 216/4885

“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.