SCHEMBL5118078

SCHEMBL5118078

CC(C)N(CCCCC(=O)N(C)Cc1ccc(C2=NCCN2C(=O)O)cc1)S(=O)(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 6/20 0.43
NR1H4 Q96RI1 4/20 0.37
HRH3 Q9Y5N1 1/20 0.33
BCHE P06276 3/20 0.33
ACHE P22303 3/20 0.33
POLB P06746 1/20 0.33
NPC1 O15118 1/20 0.32
RAB9A P51151 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
SCHEMBL5125372 0.94 BDKRB1 (0.44) BDKRB1NR1H4HRH3POLBNPC1
SCHEMBL5114361 0.91 BDKRB1 (0.50) BDKRB1NR1H4BCHEACHENPC1
SCHEMBL5124589 0.87 BDKRB1 (0.43) BDKRB1NR1H4BCHEACHEPOLB
SCHEMBL5125274 0.87 BDKRB1 (0.52) BDKRB1NR1H4NPC1RAB9A
SCHEMBL5125872 0.85 BDKRB1 (0.46) BDKRB1HRH3POLBNPC1RAB9A
SCHEMBL5118085 0.84 NR1H4 (0.36) BDKRB1NR1H4POLB
SCHEMBL5126326 0.84 BDKRB1 (0.52) BDKRB1
SCHEMBL5126485 0.84 BDKRB1 (0.49) BDKRB1BCHEACHENPC1RAB9A
SCHEMBL5111907 0.83 BDKRB1 (0.45) BDKRB1NR1H4POLB
SCHEMBL5114367 0.82 BDKRB1 (0.38) BDKRB1NPC1RAB9A

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 1217/4885NR1H4 15/4885HRH3 1614/4885

“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.