SCHEMBL2560431

SCHEMBL2560431

O=C(COCC1CCCCN1S(=O)(=O)c1c(Cl)cc(Cl)cc1Cl)N1CCC(c2cccnc2)C1

nearest known ligand 0.51

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SPR P35270 5/20 0.51
HSD11B1 P28845 1/20 0.44
F10 P00742 1/20 0.43
POLB P06746 1/20 0.42
FKBP1A P62942 1/20 0.41
FKBP4 Q02790 1/20 0.41
FKBP5 Q13451 1/20 0.41
GRM5 P41594 3/20 0.39
CASP3 P42574 1/20 0.38
CASP7 P55210 1/20 0.38
CYP3A4 P08684 1/20 0.38
CYP2C19 P33261 1/20 0.38
ALDH1A1 P00352 1/20 0.37
ADRB2 P07550 1/20 0.37
TSHR P16473 1/20 0.37

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
SCHEMBL2567500 0.90 SPR (0.48) SPRHSD11B1GRM5
SCHEMBL2567089 0.85 MAPT (0.44) SPRF10POLBCASP3CASP7
SCHEMBL2569443 0.85 GRM5 (0.45) SPRHSD11B1POLBGRM5CYP3A4
SCHEMBL2567202 0.83 LMNA (0.41) SPRF10CASP3CASP7ALDH1A1
SCHEMBL2570824 0.81 POLB (0.46) F10POLBCYP3A4CYP2C19ALDH1A1
SCHEMBL2567098 0.81 MAPT (0.44) POLBCASP3CASP7ALDH1A1
SCHEMBL3823563 0.80 ALDH1A1 (0.46) POLBGRM5CASP3CASP7CYP3A4
SCHEMBL5121787 0.78 ALDH1A1 (0.47) POLBFKBP1AFKBP4FKBP5CYP3A4
SCHEMBL2565946 0.78 CNR1 (0.42) ALDH1A1TSHR
SCHEMBL2569077 0.77 PSEN1 (0.42) CYP3A4CYP2C19

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-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
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-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 SPR 880/4885HSD11B1 2093/4885F10 3219/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 SPR 880/4885HSD11B1 2093/4885F10 3219/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 SPR 880/4885HSD11B1 2093/4885F10 3219/4885

“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.