SCHEMBL3829353

SCHEMBL3829353

COc1cc(C)c(S(=O)(=O)N(C)CCCCC(=O)N2CCC(O)(c3cccnc3)CC2)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.51
ALDH1A1 P00352 2/20 0.51
MEN1 O00255 1/20 0.46
KMT2A Q03164 1/20 0.46
BDKRB1 P46663 13/20 0.46
SMN1; SMN2 Q16637 1/20 0.42
CYP2D6 P10635 1/20 0.42
HPGD P15428 1/20 0.42
ADAMTS4 O75173 1/20 0.42
ADAMTS5 Q9UNA0 1/20 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
SCHEMBL5129014 0.97 LMNA (0.51) LMNAALDH1A1MEN1KMT2ABDKRB1
SCHEMBL5125927 0.90 BDKRB1 (0.51) LMNAALDH1A1BDKRB1
SCHEMBL3816859 0.88 BDKRB1 (0.61) LMNAALDH1A1BDKRB1
Hydrochloric Acid SCHEMBL5131909 0.87 BDKRB1 (0.60) LMNAALDH1A1BDKRB1
SCHEMBL5131418 0.80 BDKRB1 (0.52) LMNAALDH1A1BDKRB1
SCHEMBL5125892 0.80 KMT2A (0.50) LMNAALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL5125896 0.80 BDKRB1 (0.56) BDKRB1
SCHEMBL3409642 0.80 BDKRB1 (0.61) BDKRB1
Hydrochloric Acid SCHEMBL5132258 0.80 MEN1 (0.46) LMNAALDH1A1MEN1KMT2ASMN1; SMN2
SCHEMBL2833973 0.78 LMNA (0.45) LMNAALDH1A1BDKRB1SMN1; SMN2

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 10 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-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
US-8580965-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-11-12 US disclosed
EP-2086935-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES FOR USE AS BRADYKININ 1 RECEPTOR MODULATORS Grünenthal GmbH (DE) 2009-08-12 EP disclosed
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 US disclosed
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 US disclosed
US-20080249128-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2008-10-09 US disclosed
WO-2008046573-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES FOR USE AS BRADYKININ 1 RECEPTOR MODULATORS Grünenthal GmbH (DE) 2008-04-24 WO disclosed
WO-2008046573-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES FOR USE AS BRADYKININ 1 RECEPTOR MODULATORS Grünenthal GmbH (DE) 2008-04-24 WO 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 LMNA 1324/4885ALDH1A1 2737/4885MEN1 1340/4885

“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.