SCHEMBL2828302

SCHEMBL2828302

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

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.61
LMNA P02545 3/20 0.61
HIF1A Q16665 1/20 0.61
GAA P10253 3/20 0.60
POLB P06746 1/20 0.58
RECQL P46063 1/20 0.58
MEN1 O00255 5/20 0.57
KMT2A Q03164 5/20 0.57
CASP6 P55212 1/20 0.57
NPSR1 Q6W5P4 1/20 0.55
HSD17B2 P37059 1/20 0.54
MAPT P10636 2/20 0.54
CPT2 P23786 1/20 0.54
CPT1A P50416 1/20 0.54
CPT1B Q92523 1/20 0.54
USP2 O75604 1/20 0.54
ALDH1A1 P00352 1/20 0.54
TP53 P04637 1/20 0.54
MAPK1 P28482 1/20 0.54
RAB9A P51151 2/20 0.53

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
SCHEMBL2827095 0.88 MAPT (0.65) SMN1; SMN2LMNAGAAPOLBMEN1
SCHEMBL2827825 0.88 SMN1; SMN2 (0.71) SMN1; SMN2LMNAGAAMEN1KMT2A
SCHEMBL2827058 0.88 MEN1 (0.55) SMN1; SMN2LMNAHIF1AGAAPOLB
SCHEMBL2828816 0.87 NPSR1 (0.59) SMN1; SMN2LMNAHIF1AGAAPOLB
SCHEMBL2828894 0.86 SMN1; SMN2 (0.63) SMN1; SMN2LMNAHIF1AGAAMEN1
SCHEMBL2826757 0.86 MEN1 (0.70) LMNAGAAPOLBRECQLMEN1
SCHEMBL2825284 0.85 LMNA (0.63) SMN1; SMN2LMNAGAAPOLBRECQL
SCHEMBL30926596 0.84 MEN1 (0.75) LMNAGAAMEN1KMT2ACASP6
SCHEMBL27180181 0.84 MEN1 (0.75) LMNAGAAMEN1KMT2ACASP6
SCHEMBL2824645 0.83 AR (0.67) SMN1; SMN2LMNAHIF1AGAAPOLB

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 3524/4885HIF1A 851/4885
US-20120232104-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 SMN1; SMN2 2229/4885LMNA 3524/4885HIF1A 851/4885
US-20100144762-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 SMN1; SMN2 2229/4885LMNA 3524/4885HIF1A 851/4885
US-20110319438-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 SMN1; SMN2 2229/4885LMNA 3524/4885HIF1A 851/4885

“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.