SCHEMBL2567202

SCHEMBL2567202

COc1cc(C)c(S(=O)(=O)N2CCCC2COCC(=O)N2CCC(c3cccnc3)C2)c(C)c1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
CASP3 P42574 4/20 0.41
CASP7 P55210 4/20 0.41
MAPT P10636 2/20 0.41
F10 P00742 1/20 0.41
BDKRB1 P46663 5/20 0.41
CASP1 P29466 1/20 0.40
CASP6 P55212 1/20 0.40
NAMPT P43490 1/20 0.40
RAB9A P51151 2/20 0.40
NPC1 O15118 1/20 0.40
TP53 P04637 1/20 0.40
KMT2A Q03164 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
ALDH1A1 P00352 1/20 0.40
SPR P35270 1/20 0.38
PKM P14618 1/20 0.38
APLNR P35414 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
SCHEMBL2567089 0.98 MAPT (0.44) LMNACASP3CASP7MAPTF10
SCHEMBL2567098 0.94 MAPT (0.44) LMNACASP3CASP7MAPTBDKRB1
SCHEMBL2566140 0.91 BDKRB1 (0.43) LMNAMAPTBDKRB1RAB9ANPC1
SCHEMBL2571181 0.89 BDKRB1 (0.42) LMNAMAPTBDKRB1RAB9ANPC1
SCHEMBL2566323 0.88 MAPT (0.41) LMNACASP3CASP7MAPTBDKRB1
SCHEMBL2567401 0.86 NAMPT (0.42) LMNACASP3CASP7MAPTBDKRB1
SCHEMBL2568979 0.85 BDKRB1 (0.45) LMNABDKRB1
SCHEMBL3818678 0.84 ALDH1A1 (0.47) LMNACASP3CASP7BDKRB1CASP1
SCHEMBL2568862 0.84 ALDH1A1 (0.42) CASP3CASP7MAPTBDKRB1CASP1
Hydrochloric Acid SCHEMBL5132139 0.83 ALDH1A1 (0.47) LMNACASP3CASP7BDKRB1NAMPT

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-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
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 LMNA 2964/4885CASP3 2157/4885CASP7 3504/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 LMNA 2964/4885CASP3 2157/4885CASP7 3504/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 LMNA 2964/4885CASP3 2157/4885CASP7 3504/4885

“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.