SCHEMBL3879413

SCHEMBL3879413

Cc1c(S(=O)(=O)CNCc2cccc(C(=O)O)c2)sc2ccc(Cl)cc12

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PFKFB3 Q16875 9/20 0.63
PFKFB4 Q16877 9/20 0.63
CMA1 P23946 4/20 0.46
MRGPRX4 Q96LA9 1/20 0.45
F10 P00742 1/20 0.45
NPSR1 Q6W5P4 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
HTR6 P50406 1/20 0.42

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
SCHEMBL3884692 0.86 PFKFB3 (0.71) PFKFB3PFKFB4CMA1F10NPSR1
SCHEMBL3886516 0.84 PFKFB3 (0.54) PFKFB3PFKFB4CMA1
SCHEMBL3555875 0.80 PFKFB3 (0.83) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL3879417 0.79 PFKFB3 (0.61) PFKFB3PFKFB4CMA1MRGPRX4F10
SCHEMBL3553777 0.78 PFKFB3 (0.77) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL788108 0.77 PFKFB4 (1.00) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
Propane SCHEMBL28642185 0.77 PFKFB4 (0.94) PFKFB3PFKFB4CMA1NPSR1L3MBTL1
SCHEMBL3876651 0.77 PFKFB4 (0.72) PFKFB3PFKFB4CMA1F10NPSR1
SCHEMBL3556078 0.76 PFKFB3 (0.67) PFKFB3PFKFB4CMA1HTR6
SCHEMBL3883349 0.76 MRGPRX4 (0.52) MRGPRX4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1814846-B1 11BETA-HSD1 INHIBITORS EVOTEC AG (DE) 2009-04-08 EP disclosed
US-20090069323-A1 11beta-hsdi inhibitors EVOTEC AG (DE) 2009-03-12 US disclosed
EP-1814846-A1 11BETA-HSD1 INHIBITORS Evotec AG (DE) 2007-08-08 EP disclosed
WO-2006048330-A1 11ΒΕΤΑ-HSD1 INHIBITORS EVOTEC AG (DE) 2006-05-11 WO 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-20090069323-A1 11beta-hsdi inhibitors HSD3B1, HSD3B2, HSD11B1 PFKFB3 1134/4885PFKFB4 1312/4885CMA1 1665/4885

“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.