SCHEMBL2569261

SCHEMBL2569261

CC(C)N(Cc1ccc(N(C)C)cc1)C(=O)COCC1CCCCN1S(=O)(=O)c1c(Cl)cccc1Cl

nearest known ligand 0.40

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.37
L3MBTL1 Q9Y468 1/20 0.36
ATM Q13315 1/20 0.35
STAT3 P40763 1/20 0.35
KDM4E B2RXH2 1/20 0.35
MAPT P10636 3/20 0.34
TP53 P04637 2/20 0.34
POLB P06746 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
BDKRB1 P46663 1/20 0.34
PSEN1 P49768 1/20 0.33
PSEN2 P49810 1/20 0.33
APH1B Q8WW43 1/20 0.33
NCSTN Q92542 1/20 0.33
APH1A Q96BI3 1/20 0.33
PSENEN Q9NZ42 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
NR1H4 Q96RI1 1/20 0.33
TDP1 Q9NUW8 1/20 0.33

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
SCHEMBL2567004 0.85 POLB (0.37) GAAMAPTTP53POLBSMN1; SMN2
SCHEMBL2569104 0.81 CHRM5 (0.40) GAAPOLBPSEN1PSEN2APH1B
SCHEMBL2566990 0.79 OPRK1 (0.36) ATMSMN1; SMN2PSEN1PSEN2APH1B
SCHEMBL2567483 0.78 ALDH1A1 (0.45) ATMPSEN1PSEN2APH1BNCSTN
SCHEMBL5132594 0.77 ATM (0.46) ATMPSEN1PSEN2APH1BNCSTN
SCHEMBL2567263 0.76 GAA (0.42) GAAMAPTTP53POLB
SCHEMBL2567955 0.75 CCR4 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3775698 0.75 CCR4 (0.43) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL2572157 0.75 SMN1; SMN2 (0.49) GAAKDM4EMAPTTP53SMN1; SMN2
SCHEMBL5122263 0.74 ATM (0.44) ATMTDP1

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
EP-2383267-A1 Substituted sulfonamide derivatives Grünenthal GmbH (DE) 2011-11-02 EP claimed
US-20100317644-A1 Substituted Sulfonamide Compounds GRUENENTHAL GMBH (DE) 2010-12-16 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
EP-2066659-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2009-06-10 EP disclosed
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS GRUENENTHAL GMBH (DE) 2008-06-26 US disclosed
WO-2008040492-A1 SUBSTITUTED SULFONAMIDE DERIVATIVES Grünenthal GmbH (DE) 2008-04-10 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 (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 GAA 234/4885L3MBTL1 4648/4885ATM 3057/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 GAA 234/4885L3MBTL1 4648/4885ATM 3057/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 GAA 234/4885L3MBTL1 4648/4885ATM 3057/4885

“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.