SCHEMBL2828894

SCHEMBL2828894

CCOC(=O)c1ccc(NC(=O)c2cccc(NS(=O)(=O)c3cccc(Cl)c3)c2)cc1

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 5/20 0.63
LMNA P02545 3/20 0.63
TRPV1 Q8NER1 1/20 0.60
CPT2 P23786 1/20 0.59
CPT1A P50416 1/20 0.59
CPT1B Q92523 1/20 0.59
HIF1A Q16665 1/20 0.58
MEN1 O00255 4/20 0.55
KMT2A Q03164 4/20 0.55
GAA P10253 2/20 0.55
TP53 P04637 2/20 0.55
MAPT P10636 2/20 0.55
ALDH1A1 P00352 2/20 0.55
USP2 O75604 1/20 0.55
MAPK1 P28482 1/20 0.55
NPC1 O15118 1/20 0.55
RAB9A P51151 1/20 0.55
PTBP1 P26599 1/20 0.54
AR P10275 1/20 0.54
PGR P06401 1/20 0.54

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
SCHEMBL2826890 0.93 SMN1; SMN2 (0.64) SMN1; SMN2LMNATRPV1CPT2CPT1A
SCHEMBL2827825 0.90 SMN1; SMN2 (0.71) SMN1; SMN2LMNAMEN1KMT2AGAA
SCHEMBL2828039 0.90 LMNA (0.67) SMN1; SMN2LMNAHIF1ATP53MAPT
SCHEMBL3553138 0.89 LMNA (0.65) SMN1; SMN2LMNATRPV1MEN1KMT2A
SCHEMBL2825285 0.88 LMNA (0.62) SMN1; SMN2LMNATRPV1CPT2CPT1A
SCHEMBL2827095 0.88 MAPT (0.65) SMN1; SMN2LMNAMEN1KMT2AGAA
SCHEMBL2825284 0.87 LMNA (0.63) SMN1; SMN2LMNAMEN1KMT2AGAA
SCHEMBL2828302 0.86 SMN1; SMN2 (0.61) SMN1; SMN2LMNACPT2CPT1ACPT1B
SCHEMBL2828290 0.86 GPR27 (0.52) SMN1; SMN2LMNATRPV1CPT2CPT1A
SCHEMBL2824645 0.85 AR (0.67) SMN1; SMN2LMNAHIF1AMEN1KMT2A

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 SMN1; SMN2 2229/4885LMNA 3524/4885TRPV1 3029/4885
US-20120232104-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 SMN1; SMN2 2229/4885LMNA 3524/4885TRPV1 3029/4885
US-20100144762-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 SMN1; SMN2 2229/4885LMNA 3524/4885TRPV1 3029/4885
US-20110319438-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 SMN1; SMN2 2229/4885LMNA 3524/4885TRPV1 3029/4885

“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.