SCHEMBL5132282

SCHEMBL5132282

O=C(COCC1CCc2ccccc2N1S(=O)(=O)c1ccc(Cl)c(Cl)c1)N1CCC(O)(c2cccc(F)c2)CC1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RORC P51449 1/20 0.49
PSEN1 P49768 13/20 0.45
PSEN2 P49810 13/20 0.45
APH1B Q8WW43 13/20 0.45
NCSTN Q92542 13/20 0.45
APH1A Q96BI3 13/20 0.45
PSENEN Q9NZ42 13/20 0.45
BDKRB1 P46663 4/20 0.44
APP P05067 3/20 0.42

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
SCHEMBL3412507 0.89 APP (0.44) RORCPSEN1PSEN2APH1BNCSTN
SCHEMBL5128681 0.88 BDKRB1 (0.53) RORCPSEN1PSEN2APH1BNCSTN
SCHEMBL5132302 0.85 BDKRB1 (0.48) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3406152 0.85 PSEN1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3407964 0.83 APP (0.45) RORCPSEN1PSEN2APH1BNCSTN
SCHEMBL3405283 0.83 APP (0.47) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL4113323 0.81 PSEN1 (0.49) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL5128428 0.81 ALDH1A1 (0.45) RORCBDKRB1
SCHEMBL492930 0.80 PSEN1 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3413022 0.80 RORC (0.42) RORCPSEN1PSEN2APH1BNCSTN

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 RORC 3673/4885PSEN1 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.