SCHEMBL5128570

SCHEMBL5128570

COc1cc(C)c(S(=O)(=O)N2CCCC2COCC(=O)N2CCC(O)(c3cccs3)CC2)c(C)c1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 12/20 0.41
SIGMAR1 Q99720 1/20 0.39
USP2 O75604 1/20 0.37
GAA P10253 1/20 0.37

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
SCHEMBL3808551 0.98 BDKRB1 (0.41) BDKRB1SIGMAR1
SCHEMBL5123809 0.87 BDKRB1 (0.43) BDKRB1
SCHEMBL14411693 0.87 BDKRB1 (0.43) BDKRB1
SCHEMBL12694729 0.86 BDKRB1 (0.41) BDKRB1
SCHEMBL5132314 0.86 BDKRB1 (0.44) BDKRB1SIGMAR1GAA
SCHEMBL5127947 0.85 BDKRB1 (0.42) BDKRB1
SCHEMBL14411784 0.84 MEN1 (0.44) BDKRB1
SCHEMBL5131948 0.84 BDKRB1 (0.42) BDKRB1
SCHEMBL5132297 0.83 BDKRB1 (0.41) BDKRB1
SCHEMBL5125509 0.83 ATM (0.37)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 US claimed
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 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-20080249128-A1 Substituted Sulfonamide Compounds BDKRB1, BDKRB2, NPSR1 BDKRB1 1/4885SIGMAR1 108/4885USP2 3961/4885

“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.