SCHEMBL4086314

SCHEMBL4086314

Cc1cc(C)c(S(=O)(=O)N(C)CCOCC(=O)N2CCn3cccc3C2c2cccnc2)c(C)c1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
TDP1 Q9NUW8 1/20 0.46
HTT P42858 1/20 0.46
TP53 P04637 1/20 0.44
MAPT P10636 3/20 0.44
KDM4E B2RXH2 1/20 0.44
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
RECQL P46063 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
BDKRB1 P46663 9/20 0.42
GAA P10253 1/20 0.41

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
SCHEMBL4089994 0.93 BDKRB1 (0.51) ALDH1A1MAPTBDKRB1
SCHEMBL4080752 0.91 BDKRB1 (0.45) MAPTKDM4EBDKRB1
SCHEMBL4090831 0.91 MAPT (0.46) ALDH1A1TDP1HTTTP53MAPT
SCHEMBL4084340 0.88 BDKRB1 (0.41) BDKRB1
SCHEMBL4087054 0.88 BDKRB1 (0.44) BDKRB1
SCHEMBL4080254 0.87 BDKRB1 (0.42) BDKRB1
SCHEMBL4080376 0.86 BDKRB1 (0.49) BDKRB1
SCHEMBL4092041 0.86 BDKRB1 (0.45) BDKRB1
SCHEMBL4081228 0.86 BDKRB1 (0.50) MAPTBDKRB1
SCHEMBL4086000 0.86 MAPT (0.44) ALDH1A1TDP1HTTTP53MAPT

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8263598-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-09-11 US claimed
US-20090186899-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-07-23 US claimed
US-8263598-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2012-09-11 US disclosed
US-20090186899-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2009-07-23 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-20090186899-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, NPSR1 ALDH1A1 3693/4885TDP1 4426/4885HTT 3626/4885

“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.