SCHEMBL5117876

SCHEMBL5117876

CN(Cc1ccc(C2=NCCN2C(=O)O)cc1)C(=O)CCCCNCS(=O)(=O)c1ccc(Cl)cc1Cl

nearest known ligand 0.38

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 5/20 0.38
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
HPGD P15428 1/20 0.34
ALDH1A1 P00352 2/20 0.33
HTT P42858 1/20 0.33
RAB9A P51151 1/20 0.33
KDM2B Q8NHM5 1/20 0.33
DGAT1 O75907 1/20 0.32
LTB4R2 Q9NPC1 2/20 0.32
ERCC1 P07992 1/20 0.32
ERCC4 Q92889 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
LMNA P02545 1/20 0.31
F10 P00742 1/20 0.31
TP53 P04637 1/20 0.31
CNR1 P21554 1/20 0.31
CNR2 P34972 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
SCHEMBL5114092 0.91 BDKRB1 (0.43) BDKRB1ALDH1A1HTTTP53
SCHEMBL5126495 0.91 BDKRB1 (0.38) BDKRB1ALDH1A1HTTRAB9AMEN1
SCHEMBL5124690 0.90 LMNA (0.41) BDKRB1GAARAB9ADGAT1MEN1
SCHEMBL5126334 0.88 BDKRB1 (0.40) BDKRB1RAB9ADGAT1LMNATP53
SCHEMBL6761625 0.87 BDKRB1 (0.42) BDKRB1ALDH1A1KDM2BERCC1ERCC4
SCHEMBL5114367 0.87 BDKRB1 (0.38) BDKRB1ALDH1A1HTTRAB9ADGAT1
SCHEMBL5118845 0.86 BDKRB1 (0.50) BDKRB1DGAT1LMNA
SCHEMBL5119727 0.86 BDKRB1 (0.38) BDKRB1HTTRAB9AMEN1KMT2A
SCHEMBL5119110 0.85 BDKRB1 (0.40) BDKRB1RAB9ADGAT1LMNATP53
SCHEMBL5117882 0.85 CNR1 (0.34) KDM4EALDH1A1KDM2BLMNACNR1

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 1217/4885KDM4E 3264/4885GAA 215/4885

“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.