SCHEMBL5124602

SCHEMBL5124602

CN(Cc1ccc(C2=NCCN2C(=O)O)cc1)C(=O)/C=C/CN(C)S(=O)(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 7/20 0.49
TP53 P04637 1/20 0.34
NR1H4 Q96RI1 2/20 0.34
DAGLA Q9Y4D2 1/20 0.33
KDM2B Q8NHM5 1/20 0.32
MEN1 O00255 1/20 0.31
ALDH1A1 P00352 1/20 0.31
KMT2A Q03164 1/20 0.31
TSHR P16473 1/20 0.31
ABL1 P00519 1/20 0.31
RIN1 Q13671 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
SCHEMBL5117603 0.91 BDKRB1 (0.54) BDKRB1TP53MEN1ALDH1A1KMT2A
SCHEMBL5114202 0.91 BDKRB1 (0.52) BDKRB1TP53KDM2BMEN1ALDH1A1
SCHEMBL5114358 0.90 BDKRB1 (0.56) BDKRB1TP53MEN1ALDH1A1KMT2A
SCHEMBL5111180 0.90 BDKRB1 (0.43) BDKRB1KDM2BMEN1KMT2A
SCHEMBL5125279 0.89 BDKRB1 (0.45) BDKRB1TP53
SCHEMBL5125270 0.89 BDKRB1 (0.45) BDKRB1TP53
SCHEMBL5111518 0.87 BDKRB1 (0.59) BDKRB1TP53MEN1ALDH1A1KMT2A
SCHEMBL5124621 0.86 BDKRB1 (0.45) BDKRB1ALDH1A1
SCHEMBL5114584 0.86 BDKRB1 (0.53) BDKRB1TP53KDM2BALDH1A1
SCHEMBL5114098 0.86 BDKRB1 (0.53) BDKRB1TP53KDM2BMEN1ALDH1A1

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 2886/4885NR1H4 15/4885

“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.