SCHEMBL5118486

SCHEMBL5118486

CN(Cc1ccc(C2=NCCN2C(=O)O)cc1)C(=O)COCCN(C)S(=O)(=O)c1ccccc1C#N

nearest known ligand 0.69

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 13/20 0.69
KDM2B Q8NHM5 1/20 0.35
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
RAB9A P51151 2/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
NPC1 O15118 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL4035141 0.91 BDKRB1 (0.71) BDKRB1KDM2BALDH1A1HTTRAB9A
SCHEMBL5111217 0.88 BDKRB1 (0.60) BDKRB1ALDH1A1HTT
SCHEMBL5125079 0.87 BDKRB1 (0.52) BDKRB1SMN1; SMN2
SCHEMBL5110325 0.86 BDKRB1 (0.69) BDKRB1RAB9AMEN1KMT2A
SCHEMBL5118493 0.86 BDKRB1 (0.51) BDKRB1KDM2BALDH1A1RAB9ANPC1
SCHEMBL5119631 0.85 BDKRB1 (0.51) BDKRB1ALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5118014 0.85 BDKRB1 (0.69) BDKRB1ALDH1A1
SCHEMBL5119349 0.85 BDKRB1 (0.56) BDKRB1
SCHEMBL5125500 0.85 BDKRB1 (0.59) BDKRB1RAB9AMEN1KMT2ANPC1
SCHEMBL5118227 0.85 BDKRB1 (0.69) 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 1217/4885KDM2B 2970/4885ALDH1A1 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.