SCHEMBL5114297

SCHEMBL5114297

Cc1cc(OC(F)(F)F)ccc1S(=O)(=O)CNCCCCC(=O)CNCc1ccc(C2=NCCN2C(=O)O)cc1

nearest known ligand 0.34

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 2/20 0.34
GCGR P47871 6/20 0.33
SCN8A Q9UQD0 1/20 0.32
AVPR1B P47901 1/20 0.32
EPHX2 P34913 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
ALDH1A1 P00352 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL5119291 0.92 SLC2A1 (0.37) SLC2A1ALDH1A1
SCHEMBL5114290 0.88 BDKRB1 (0.35) GCGREPHX2
SCHEMBL5118264 0.86 SLC2A1 (0.35) SLC2A1AVPR1BEPHX2ALDH1A1
SCHEMBL5114099 0.84 SLC2A1 (0.37) SLC2A1ALDH1A1RAB9A
SCHEMBL5119728 0.82 LMNA (0.31)
SCHEMBL5125538 0.81 BDKRB1 (0.38) SLC2A1ALDH1A1
SCHEMBL5126502 0.79 KMT2A (0.34) EPHX2ALDH1A1
SCHEMBL5118850 0.79 LMNA (0.42)
SCHEMBL5125825 0.79 MEN1 (0.35) SLC2A1ALDH1A1
SCHEMBL5119282 0.79 BDKRB1 (0.42) SLC2A1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7361687-B2 Arylsulphonamide derivatives and methods of preparing LABORATOIRES FOURNIER SA (FR) 2008-04-22 US disclosed
US-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents LABORATOIRES FOURNIER SA (FR) 2006-04-20 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-20060084699-A1 Novel arylsulphonamide derivatives and use thereof as therapeutic agents UGT1A1, UGT2B7, UGT1A6 SLC2A1 2323/4885GCGR 1878/4885SCN8A 3739/4885

“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.