SCHEMBL5117869

SCHEMBL5117869

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

nearest known ligand 0.50

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 12/20 0.50
TP53 P04637 1/20 0.38
KDM2B Q8NHM5 1/20 0.36
KDM4E B2RXH2 1/20 0.35
GAA P10253 1/20 0.35
HPGD P15428 1/20 0.35
ALDH1A1 P00352 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL5114090 0.91 BDKRB1 (0.55) BDKRB1TP53ALDH1A1
SCHEMBL5126485 0.90 BDKRB1 (0.49) BDKRB1TP53
SCHEMBL5124683 0.90 BDKRB1 (0.49) BDKRB1TP53L3MBTL1
SCHEMBL5118568 0.89 BDKRB1 (0.57) BDKRB1TP53L3MBTL1
SCHEMBL5118277 0.88 BDKRB1 (0.66) BDKRB1TP53L3MBTL1
SCHEMBL5126326 0.87 BDKRB1 (0.52) BDKRB1TP53
SCHEMBL5114361 0.86 BDKRB1 (0.50) BDKRB1TP53
SCHEMBL5118841 0.85 BDKRB1 (0.69) BDKRB1TP53L3MBTL1
SCHEMBL5119725 0.85 BDKRB1 (0.52) BDKRB1TP53
SCHEMBL5117876 0.85 BDKRB1 (0.38) BDKRB1TP53KDM2BKDM4EGAA

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 2886/4885KDM2B 2970/4885

“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.