SCHEMBL2015204

SCHEMBL2015204

O=C(NCCCCCCNC(=O)NS(=O)(=O)c1ccc(CO)s1)NS(=O)(=O)c1ccc(CO)s1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 14/20 0.47
CYP2C9 P11712 2/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42
ALB P02768 1/20 0.42
TSHR P16473 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HTT P42858 1/20 0.39
MAPK1 P28482 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38

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
SCHEMBL2012755 0.81 KMT2A (0.56) FBP1ALDH1A1TSHRHTTSMN1; SMN2
SCHEMBL2007912 0.81 FBP1 (0.53) FBP1CYP2C9ALDH1A1LMNAALB
SCHEMBL2008042 0.81 FBP1 (0.53) FBP1CYP2C9ALDH1A1LMNAALB
SCHEMBL2008078 0.81 SMN1; SMN2 (0.55) FBP1HTTMAPK1SMN1; SMN2
SCHEMBL2007213 0.80 FBP1 (0.47) FBP1CYP2C9ALDH1A1LMNAALB
SCHEMBL2008704 0.78 FBP1 (0.48) FBP1CYP2C9ALDH1A1LMNAALB
SCHEMBL2007670 0.77 LMNA (0.56) FBP1CYP2C9ALDH1A1LMNAALB
SCHEMBL2005603 0.74 CYP2D6 (0.54) FBP1CYP2C9ALDH1A1TSHR
SCHEMBL2007978 0.71 HTT (0.53) FBP1CYP2C9ALDH1A1LMNAALB
SCHEMBL27755923 0.70 MEN1 (0.41) ALDH1A1TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2081889-B1 SULFONAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-12-22 EP claimed
US-7964633-B2 such as N,N'-[hexane-1,6-diylbis(iminocarbonyl)]bis(3-chlorobenzenesulfonamide), used as Fructose-1,6-bisphosphatase inhibitors; metabolic disorders such as diabetes HOFFMANN-LA ROCHE INC. (US) 2011-06-21 US disclosed
EP-2081889-B1 SULFONAMIDE DERIVATIVES HOFFMANN LA ROCHE (CH) 2010-12-22 EP disclosed
EP-2081889-A1 SULFONAMIDE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2009-07-29 EP disclosed
US-20080085928-A1 Sulfonamide derivatives HOFFMANN-LA ROCHE INC. 2008-04-10 US disclosed
WO-2008037628-A1 SULFONAMIDE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2008-04-03 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-20080085928-A1 Sulfonamide derivatives SULT2A1, SULT1A1, SULT1E1 FBP1 2209/4885CYP2C9 49/4885ALDH1A1 168/4885

“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.