SCHEMBL5111654

SCHEMBL5111654

COc1ccc(S(=O)(=O)CNCC=CC(=O)N(C)Cc2ccc(C3=NCCN3C(=O)O)cc2)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 3/20 0.41
TP53 P04637 1/20 0.32
HSP90AA1 P07900 1/20 0.32
KAT8 Q9H7Z6 4/20 0.32
KAT6A Q92794 1/20 0.32
CCR1 P32246 1/20 0.32
ALDH1A1 P00352 1/20 0.31
ACLY P53396 1/20 0.31
ROCK2 O75116 1/20 0.31
CYP2C9 P11712 1/20 0.31
ROCK1 Q13464 1/20 0.31
CDC42BPA Q5VT25 1/20 0.31
THRB P10828 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
SCHEMBL5111645 1.00 BDKRB1 (0.41) BDKRB1TP53HSP90AA1KAT8KAT6A
SCHEMBL5114589 0.91 BDKRB1 (0.40) BDKRB1TP53ALDH1A1
SCHEMBL5114598 0.91 BDKRB1 (0.40) BDKRB1TP53ALDH1A1
SCHEMBL5124199 0.90 BDKRB1 (0.40) BDKRB1CCR1
SCHEMBL5124193 0.90 BDKRB1 (0.40) BDKRB1CCR1
SCHEMBL5114204 0.88 BDKRB1 (0.40) BDKRB1TP53ALDH1A1
SCHEMBL5114211 0.88 BDKRB1 (0.40) BDKRB1TP53ALDH1A1
SCHEMBL5118814 0.87 LMNA (0.41) BDKRB1TP53CCR1
SCHEMBL5118801 0.87 LMNA (0.41) BDKRB1TP53CCR1
SCHEMBL5111522 0.87 BDKRB1 (0.44) 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 1217/4885TP53 2886/4885HSP90AA1 959/4885

“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.