SCHEMBL5132302

SCHEMBL5132302

O=C(COCC1CCc2ccccc2N1S(=O)(=O)c1ccc(Cl)c(Cl)c1)N1CCC(O)(c2ccccn2)CC1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 4/20 0.48
PSEN1 P49768 14/20 0.45
PSEN2 P49810 14/20 0.45
APH1B Q8WW43 14/20 0.45
NCSTN Q92542 14/20 0.45
APH1A Q96BI3 14/20 0.45
PSENEN Q9NZ42 14/20 0.45
APP P05067 3/20 0.43

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
SCHEMBL5128681 0.89 BDKRB1 (0.53) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL5132282 0.85 RORC (0.49) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL5126164 0.84 RECQL (0.47)
SCHEMBL5132569 0.84 RECQL (0.44)
SCHEMBL3406152 0.82 PSEN1 (0.49) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL3402856 0.82 BDKRB1 (0.47) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL4113323 0.82 PSEN1 (0.49) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL3405283 0.81 APP (0.47) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL4383315 0.81 APP (0.49) BDKRB1PSEN1PSEN2APH1BNCSTN
SCHEMBL5128428 0.80 ALDH1A1 (0.45) 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 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 1/4885PSEN1 784/4885PSEN2 878/4885

“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.