SCHEMBL2824645

SCHEMBL2824645

CCOC(=O)c1ccc(NC(=O)c2cccc(NS(=O)(=O)c3ccc4ccccc4c3)c2)cc1

nearest known ligand 0.67

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AR P10275 1/20 0.67
SMN1; SMN2 Q16637 6/20 0.65
LMNA P02545 4/20 0.65
GPR27 Q9NS67 1/20 0.62
PLAU P00749 2/20 0.57
HIF1A Q16665 1/20 0.57
GAA P10253 3/20 0.57
NPC1 O15118 2/20 0.57
RAB9A P51151 2/20 0.57
ALDH1A1 P00352 2/20 0.54
POLB P06746 1/20 0.53
CASP3 P42574 1/20 0.53
SENP8 Q96LD8 1/20 0.53
SENP7 Q9BQF6 1/20 0.53
SENP6 Q9GZR1 1/20 0.53
MEN1 O00255 3/20 0.53
KMT2A Q03164 3/20 0.53
CYP1A2 P05177 1/20 0.53
CYP3A4 P08684 1/20 0.53
CYP2D6 P10635 1/20 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
SCHEMBL7319886 0.90 LMNA (0.69) ARSMN1; SMN2LMNAPLAUHIF1A
SCHEMBL2827825 0.89 SMN1; SMN2 (0.71) ARSMN1; SMN2LMNAGAANPC1
SCHEMBL7791354 0.88 PLAU (0.72) ARSMN1; SMN2LMNAPLAUHIF1A
SCHEMBL2826756 0.87 SMN1; SMN2 (0.69) SMN1; SMN2LMNAGAANPC1RAB9A
SCHEMBL3553138 0.86 LMNA (0.65) SMN1; SMN2LMNAGPR27GAANPC1
SCHEMBL2825284 0.86 LMNA (0.63) ARSMN1; SMN2LMNAGAANPC1
SCHEMBL2828894 0.85 SMN1; SMN2 (0.63) ARSMN1; SMN2LMNAHIF1AGAA
SCHEMBL2827095 0.85 MAPT (0.65) ARSMN1; SMN2LMNAGAANPC1
SCHEMBL2825009 0.84 GPR27 (0.74) SMN1; SMN2LMNAGPR27GAAALDH1A1
SCHEMBL2826890 0.84 SMN1; SMN2 (0.64) ARSMN1; SMN2LMNAGAANPC1

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 AR 3681/4885SMN1; SMN2 2229/4885LMNA 3524/4885
US-20120232104-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 AR 3681/4885SMN1; SMN2 2229/4885LMNA 3524/4885
US-20100144762-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 AR 3681/4885SMN1; SMN2 2229/4885LMNA 3524/4885
US-20110319438-A1 NOVEL SULFONAMIDES AS L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 AR 3681/4885SMN1; SMN2 2229/4885LMNA 3524/4885

“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.