SCHEMBL2567150

SCHEMBL2567150

COc1cc(C)c(S(=O)(=O)N2Cc3ccccc3CC2COCC(=O)N2CCCCC2Cc2cccc(C)n2)c(C)c1C

nearest known ligand 0.34

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.34
CPT2 P23786 1/20 0.34
CPT1A P50416 1/20 0.34
BCHE P06276 1/20 0.33
ACHE P22303 1/20 0.33
LMNA P02545 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
EPHX2 P34913 1/20 0.32
HCRTR1 O43613 3/20 0.32
HCRTR2 O43614 3/20 0.32
NR1D1 P20393 2/20 0.32
AVPR1B P47901 1/20 0.32
ALDH1A1 P00352 1/20 0.32
DAGLB Q8NCG7 3/20 0.31
MAPT P10636 1/20 0.31
HTT P42858 1/20 0.31

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
SCHEMBL2569191 0.84 EPHX2 (0.36) CPT2CPT1ASMN1; SMN2EPHX2NR1D1
SCHEMBL5128035 0.79 TP53 (0.41) HTR6LMNAEPHX2AVPR1BMAPT
SCHEMBL2564067 0.79 MEN1 (0.40) LMNASMN1; SMN2HCRTR1HCRTR2ALDH1A1
SCHEMBL2567224 0.77 BDKRB1 (0.38) HTR6EPHX2AVPR1B
SCHEMBL2566086 0.77 BMP1 (0.42) LMNAAVPR1BALDH1A1MAPT
SCHEMBL2569905 0.76 BDKRB1 (0.48) HTR6ACHEEPHX2AVPR1BALDH1A1
SCHEMBL2562887 0.76 BDKRB1 (0.48) HTR6ACHEAVPR1BALDH1A1HTT
SCHEMBL2570935 0.76 TP53 (0.36) LMNASMN1; SMN2ALDH1A1MAPTHTT
SCHEMBL2565923 0.76 BDKRB1 (0.50) HTR6EPHX2AVPR1B
SCHEMBL2564083 0.75 TP53 (0.35) LMNASMN1; SMN2ALDH1A1MAPTHTT

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 HTR6 1229/4885CPT2 3574/4885CPT1A 2348/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 HTR6 1229/4885CPT2 3574/4885CPT1A 2348/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 HTR6 1229/4885CPT2 3574/4885CPT1A 2348/4885

“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.