SCHEMBL5115076

SCHEMBL5115076

Cc1cccc(S(=O)(=O)N(C)CCCCC(=O)N(C)Cc2ccc(C3=NCCN3C(=O)O)cc2)c1

nearest known ligand 0.42

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 9/20 0.42
CNR2 P34972 1/20 0.38
ALDH1A1 P00352 2/20 0.37
KMT2A Q03164 2/20 0.37
MEN1 O00255 1/20 0.37
HPGD P15428 1/20 0.37
TDP1 Q9NUW8 1/20 0.35
TLR8 Q9NR97 1/20 0.34
MAPT P10636 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33

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
SCHEMBL5118079 0.87 BDKRB1 (0.49) BDKRB1CNR2ALDH1A1KMT2AMEN1
SCHEMBL5114361 0.85 BDKRB1 (0.50) BDKRB1
SCHEMBL5119725 0.85 BDKRB1 (0.52) BDKRB1
SCHEMBL5126326 0.83 BDKRB1 (0.52) BDKRB1
SCHEMBL5110784 0.83 BDKRB1 (0.43) BDKRB1
SCHEMBL5126485 0.83 BDKRB1 (0.49) BDKRB1
SCHEMBL5124683 0.82 BDKRB1 (0.49) BDKRB1
SCHEMBL5111773 0.82 BDKRB1 (0.53) BDKRB1
SCHEMBL5117869 0.81 BDKRB1 (0.50) BDKRB1ALDH1A1HPGD
SCHEMBL5119278 0.81 BDKRB1 (0.54) BDKRB1ALDH1A1TDP1SMN1; SMN2

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 1217/4885CNR2 796/4885ALDH1A1 73/4885

“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.