SCHEMBL2568314

SCHEMBL2568314

Cc1cc(C)c(S(=O)(=O)N2CCCCC2COCC(=O)N2CCC(N3CCCC3)CC2)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
EBP Q15125 2/20 0.51
DHCR7 Q9UBM7 2/20 0.51
CYP2D6 P10635 1/20 0.46
CYP2C19 P33261 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
BDKRB1 P46663 6/20 0.44
L3MBTL3 Q96JM7 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39
ACHE P22303 1/20 0.39
NPC1 O15118 1/20 0.39
KDM4E B2RXH2 1/20 0.39
PSEN1 P49768 1/20 0.38
PSEN2 P49810 1/20 0.38
APH1B Q8WW43 1/20 0.38
NCSTN Q92542 1/20 0.38
APH1A Q96BI3 1/20 0.38
PSENEN Q9NZ42 1/20 0.38

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
SCHEMBL2572140 0.99 EBP (0.53) EBPDHCR7CYP2D6CYP2C19NPSR1
SCHEMBL2564178 0.94 BDKRB1 (0.51) EBPDHCR7CYP2D6CYP2C19NPSR1
SCHEMBL2568300 0.93 BDKRB1 (0.51) EBPDHCR7CYP2D6CYP2C19NPSR1
SCHEMBL14411516 0.90 BDKRB1 (0.45) EBPDHCR7CYP2D6CYP2C19NPSR1
SCHEMBL14411629 0.90 BDKRB1 (0.54) EBPDHCR7CYP2D6CYP2C19NPSR1
SCHEMBL2563595 0.90 BDKRB1 (0.54) EBPDHCR7CYP2D6CYP2C19NPSR1
SCHEMBL2568305 0.89 BDKRB1 (0.53) EBPDHCR7CYP2D6CYP2C19NPSR1
SCHEMBL14411601 0.89 BDKRB1 (0.53) EBPDHCR7CYP2D6CYP2C19NPSR1
SCHEMBL2570551 0.87 BDKRB1 (0.52) CYP2D6CYP2C19NPSR1BDKRB1KMT2A
SCHEMBL2568702 0.87 BDKRB1 (0.62) CYP2D6CYP2C19NPSR1BDKRB1ACHE

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-2066659-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2013-08-28 EP claimed
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
EP-2066659-B1 SUBSTITUTED SULFONAMIDE DERIVATIVES GRUENENTHAL GMBH (DE) 2013-08-28 EP disclosed
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 EBP 2591/4885DHCR7 3304/4885CYP2D6 307/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 EBP 2591/4885DHCR7 3304/4885CYP2D6 307/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 EBP 2591/4885DHCR7 3304/4885CYP2D6 307/4885

“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.