SCHEMBL5403354

SCHEMBL5403354

Cc1ccc(C)c(S(=O)(=O)Nc2ccc(Nc3ncc(C(=O)c4ccccc4C)s3)cc2)c1

nearest known ligand 0.55

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
MAPK13 O15264 7/20 0.49
MAPK12 P53778 7/20 0.49
MAPK11 Q15759 7/20 0.49
MAPK14 Q16539 7/20 0.49
GAA P10253 1/20 0.48
TSHR P16473 1/20 0.48
RAB9A P51151 1/20 0.47
SMN1; SMN2 Q16637 1/20 0.47

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
SCHEMBL5398164 0.93 NPC1 (0.50) MAPK13MAPK12MAPK11MAPK14RAB9A
SCHEMBL5401082 0.91 MAPK13 (0.54) ALDH1A1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5392778 0.91 MEN1 (0.53) ALDH1A1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5401470 0.91 MAPK13 (0.56) MAPK13MAPK12MAPK11MAPK14RAB9A
SCHEMBL5393290 0.88 HTT (0.47) MAPK13MAPK12MAPK11MAPK14TSHR
SCHEMBL5409011 0.85 MAPK13 (0.53) ALDH1A1MAPK13MAPK12MAPK11MAPK14
SCHEMBL5559808 0.84 HTT (0.43) MAPK13MAPK12MAPK11MAPK14TSHR
SCHEMBL5409022 0.84 MAPK13 (0.52) MAPK13MAPK12MAPK11MAPK14RAB9A
SCHEMBL5407137 0.84 MAPK13 (0.55) MAPK13MAPK12MAPK11MAPK14RAB9A
SCHEMBL5398193 0.84 MEN1 (0.53) ALDH1A1MAPK13MAPK12MAPK11MAPK14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658288-B1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-12-05 EP claimed
US-7250431-B2 neuropeptide Y(NPY) receptor antagonists; useful in the treatment of obesity; such as 4-methoxy-N-{4-[5-(2-methyl-benzoyl)-thiazol-2-ylamino]-phenyl}-benzenesulfonamide HOFFMANN-LA ROCHE INC. (US) 2007-07-31 US claimed
JP-2007501823-A 2007-02-01 JP claimed
EP-1658288-A1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-05-24 EP claimed
WO-2005014592-A1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-02-17 WO claimed
US-20050038089-A1 neuropeptide Y(NPY) receptor antagonists; useful in the treatment of obesity; such as 4-methoxy-N-{4-[5-(2-methyl-benzoyl)-thiazol-2-ylamino]-phenyl}-benzenesulfonamide HOFFMAN-LA ROCHE INC. 2005-02-17 US claimed
EP-1658288-B1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS HOFFMANN LA ROCHE (CH) 2007-12-05 EP disclosed
US-7250431-B2 neuropeptide Y(NPY) receptor antagonists; useful in the treatment of obesity; such as 4-methoxy-N-{4-[5-(2-methyl-benzoyl)-thiazol-2-ylamino]-phenyl}-benzenesulfonamide HOFFMANN-LA ROCHE INC. (US) 2007-07-31 US disclosed
EP-1658288-A1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2006-05-24 EP disclosed
WO-2005014592-A1 2-AMINO-5-BENZOYLTHIAZOLE NPY ANTAGONISTS F. HOFFMANN-LA ROCHE AG (CH) 2005-02-17 WO disclosed
US-20050038089-A1 neuropeptide Y(NPY) receptor antagonists; useful in the treatment of obesity; such as 4-methoxy-N-{4-[5-(2-methyl-benzoyl)-thiazol-2-ylamino]-phenyl}-benzenesulfonamide HOFFMAN-LA ROCHE INC. 2005-02-17 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 (1 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-20050038089-A1 neuropeptide Y(NPY) receptor antagonists; useful in the treatment of obesity; such as 4-methoxy-N-{4-[5-(2-methyl-benzoyl)-thiazol-2-ylamino]-phenyl}-benzenesulfonamide NPY5R, NPY1R, NPY4R ALDH1A1 3138/4885MAPK13 1352/4885MAPK12 1899/4885

“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.