SCHEMBL5114290

SCHEMBL5114290

Cc1cc(OC(F)(F)F)ccc1S(=O)(=O)CNCCCCC(=O)N(C)Cc1ccc(C2=NCCN2C(=O)O)cc1

nearest known ligand 0.35

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 4/20 0.35
GCGR P47871 5/20 0.34
SCN9A Q15858 4/20 0.32
TRPM8 Q7Z2W7 2/20 0.32
SCN10A Q9Y5Y9 1/20 0.32
PDE3B Q13370 1/20 0.31
PDE3A Q14432 1/20 0.31
EPHX2 P34913 1/20 0.31

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
SCHEMBL5119282 0.92 BDKRB1 (0.42) BDKRB1PDE3BPDE3A
SCHEMBL5114297 0.88 SLC2A1 (0.34) GCGREPHX2
SCHEMBL5114280 0.86 BDKRB1 (0.45) BDKRB1GCGRTRPM8
SCHEMBL5118256 0.86 SMN1; SMN2 (0.35) BDKRB1PDE3BPDE3AEPHX2
SCHEMBL4192372 0.84 BDKRB1 (0.52) BDKRB1
SCHEMBL5114092 0.84 BDKRB1 (0.43) BDKRB1PDE3BPDE3A
SCHEMBL5124690 0.83 LMNA (0.41) BDKRB1
SCHEMBL5119727 0.82 BDKRB1 (0.38) BDKRB1
SCHEMBL5117876 0.82 BDKRB1 (0.38) BDKRB1
SCHEMBL5125528 0.81 BDKRB1 (0.52) BDKRB1

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 BDKRB1 1217/4885GCGR 1878/4885SCN9A 3535/4885

“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.