SCHEMBL2569736

SCHEMBL2569736

COc1cc(C)c(S(=O)(=O)N2CCCC2COCC(=O)N(Cc2ccccc2)c2cccc(C)n2)c(C)c1

nearest known ligand 0.39

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 2/20 0.39
FFAR1 O14842 6/20 0.36
CHRM5 P08912 1/20 0.35
LOX P28300 1/20 0.35
CASP3 P42574 1/20 0.35
CASP7 P55210 1/20 0.35
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
NPSR1 Q6W5P4 1/20 0.35

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
SCHEMBL2568665 0.98 RAB9A (0.37) RAB9AFFAR1CHRM5GAASMN1; SMN2
SCHEMBL2567109 0.87 GAA (0.40) RAB9ACASP3CASP7GAASMN1; SMN2
SCHEMBL2566939 0.85 GAA (0.39) RAB9AGAASMN1; SMN2NPSR1
SCHEMBL2568201 0.81 LOX (0.36) FFAR1LOXGAASMN1; SMN2NPSR1
SCHEMBL2567952 0.79 BDKRB1 (0.41) RAB9ACHRM5
SCHEMBL2567086 0.78 ALDH1A1 (0.38) RAB9ACHRM5CASP3CASP7
SCHEMBL3441446 0.78 RAB9A (0.43) RAB9AFFAR1CASP3CASP7
SCHEMBL2560595 0.78 RAB9A (0.43) RAB9AFFAR1CASP3CASP7
SCHEMBL2567023 0.77 CCR4 (0.43)
SCHEMBL2564067 0.77 MEN1 (0.40) RAB9ACASP3CASP7SMN1; SMN2NPSR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2383267-A1 Substituted sulfonamide derivatives Grünenthal GmbH (DE) 2011-11-02 EP claimed
US-20100324009-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-23 US claimed
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS GRUENENTHAL GMBH (DE) 2008-06-26 US claimed
US-8435978-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-05-07 US disclosed
EP-2383267-A1 Substituted sulfonamide derivatives Grünenthal GmbH (DE) 2011-11-02 EP disclosed
US-20100324009-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-23 US disclosed
US-20100317644-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-16 US disclosed
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS GRUENENTHAL GMBH (DE) 2008-06-26 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 (3 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-20100317644-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 RAB9A 2794/4885FFAR1 1661/4885CHRM5 4237/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 RAB9A 2794/4885FFAR1 1661/4885CHRM5 4237/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 RAB9A 2794/4885FFAR1 1661/4885CHRM5 4237/4885

“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.