SCHEMBL751204

SCHEMBL751204

CCOC(=O)c1ccc(NC(=O)c2ccc(OCc3ccccc3)c([N+](=O)[O-])c2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 0.69
MEN1 O00255 5/20 0.69
KMT2A Q03164 5/20 0.69
ALDH1A1 P00352 4/20 0.62
SMN1; SMN2 Q16637 4/20 0.62
GAA P10253 3/20 0.62
POLB P06746 3/20 0.62
CTDSP1 Q9GZU7 1/20 0.62
LMNA P02545 2/20 0.60
TDP1 Q9NUW8 2/20 0.59
CYP3A4 P08684 1/20 0.59
TSHR P16473 1/20 0.59
L3MBTL1 Q9Y468 2/20 0.59
NPC1 O15118 1/20 0.57
RAB9A P51151 1/20 0.57
PPIA P62937 1/20 0.55
RECQL P46063 1/20 0.54
BLM P54132 1/20 0.54
CACNA1B Q00975 1/20 0.54
APBA1 Q02410 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
SCHEMBL5299658 0.89 ABCB1 (0.55) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL753131 0.88 MAPT (0.60) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL6817979 0.83 POLB (0.79) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL24710962 0.82 KMT2A (1.00) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL16004812 0.81 MEN1 (0.64) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL11091089 0.81 CTSV (0.57) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL751415 0.80 KMT2A (0.62) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL2827099 0.79 ALDH1A1 (0.66) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL16005076 0.79 MAPT (0.61) MAPTMEN1KMT2AALDH1A1SMN1; SMN2
SCHEMBL7344812 0.78 MEN1 (0.57) MAPTMEN1KMT2AALDH1A1SMN1; SMN2

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 9 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1996563-B1 HETEROBICYCLIC SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF DIABETES HOFFMANN LA ROCHE (CH) 2012-03-21 EP disclosed
US-8030308-B2 Bicyclic sulfonamide derivatives which are L-CPT 1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2011-10-04 US disclosed
US-20110046112-A1 NOVEL BICYCLIC SULFONAMIDE DERIVATIVES WHICH ARE L-CPT1 INHIBITORS ACKERMANN JEAN 2011-02-24 US disclosed
US-7879845-B2 Liver carnitine-dependent palmitoyltransferase (L-CPT1) inhibitors such as 4-{[4-(5-Chloro-2-methoxy-benzenesulfonyl)-3,4-dihydro-2H-benzo[1,4]thiazine-6-carbonyl]-amino}-benzoic acid, used for the treatment of non-insulin dependent diabetes; antidiabetic agents HOFFMANN-LA ROCHE INC. (US) 2011-02-01 US disclosed
US-20100130484-A1 NOVEL BICYCLIC SULFONAMIDE DERIVATIVES WHICH ARE L-CPT1 INHIBITORS ACKERMANN JEAN 2010-05-27 US disclosed
US-7696200-B2 Bicyclic sulfonamide derivatives which are L-CPT1 inhibitors HOFFMANN-LA ROCHE INC. (US) 2010-04-13 US disclosed
EP-1996563-A1 HETEROBICYCLIC SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF DIABETES F.HOFFMANN-LA ROCHE AG (CH) 2008-12-03 EP disclosed
WO-2007093507-A1 HETEROBICYCLIC SULFONAMIDE DERIVATIVES FOR THE TREATMENT OF DIABETES F. HOFFMANN-LA ROCHE AG (CH) 2007-08-23 WO disclosed
US-20070191603-A1 Novel bicyclic sulfonamide derivatives which are L-CPT1 inhibitors F. HOFFMANN-LA ROCHE AG, A SWISS COMPANY (CH) 2007-08-16 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 (3 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-20110046112-A1 NOVEL BICYCLIC SULFONAMIDE DERIVATIVES WHICH ARE L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 MAPT 3162/4885MEN1 4556/4885KMT2A 2316/4885
US-20100130484-A1 NOVEL BICYCLIC SULFONAMIDE DERIVATIVES WHICH ARE L-CPT1 INHIBITORS CPT1A, CPT1B, CPT2 MAPT 3162/4885MEN1 4556/4885KMT2A 2316/4885
US-20070191603-A1 Novel bicyclic sulfonamide derivatives which are L-CPT1 inhibitors CPT1A, CPT1B, CPT2 MAPT 3162/4885MEN1 4556/4885KMT2A 2316/4885

“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.