SCHEMBL3775346

SCHEMBL3775346

O=C(COCC1Cc2ccccc2CN1S(=O)(=O)c1ccc(Cl)cc1Cl)N1CCC(CCN2CCCC2)CC1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 4/20 0.37
DRD2 P14416 4/20 0.36
DRD3 P35462 1/20 0.36
THRB P10828 1/20 0.36
POLB P06746 2/20 0.36
HTT P42858 1/20 0.36
GAA P10253 2/20 0.35
HPGD P15428 1/20 0.35
TSHR P16473 1/20 0.35
CPT2 P23786 1/20 0.35
CPT1A P50416 1/20 0.35
MAPT P10636 1/20 0.35
HTR1A P08908 1/20 0.35
HTR2A P28223 1/20 0.35
HTR7 P34969 1/20 0.35
HTR6 P50406 1/20 0.35
TRPV4 Q9HBA0 1/20 0.35
PSEN1 P49768 2/20 0.34
PSEN2 P49810 2/20 0.34
APH1B Q8WW43 2/20 0.34

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
SCHEMBL2568226 1.00 GRM5 (0.37) GRM5DRD2DRD3THRBPOLB
SCHEMBL2571091 0.88 PSEN1 (0.43) GRM5PSEN1PSEN2APH1BNCSTN
SCHEMBL2570113 0.88 PSEN1 (0.44) PSEN1PSEN2APH1BNCSTNAPH1A
SCHEMBL3772158 0.86 CACNA2D1 (0.42) GRM5THRBPOLBGAAHTR6
SCHEMBL2564657 0.86 CACNA2D1 (0.42) GRM5THRBPOLBGAAHTR6
SCHEMBL2568399 0.85 ACHE (0.43) GRM5DRD2POLBGAAMAPT
SCHEMBL2569723 0.85 TRPV4 (0.48) GRM5THRBPOLBMAPTTRPV4
SCHEMBL2566754 0.84 GRM5 (0.40) GRM5DRD2POLBGAAMAPT
SCHEMBL3769761 0.84 GRM5 (0.40) GRM5DRD2POLBGAAMAPT
SCHEMBL2567979 0.83 HRH3 (0.44) POLBCPT2CPT1A

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
US-8435978-B2 Substituted sulfonamide compounds GRUENENTHAL GMBH (DE) 2013-05-07 US 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
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 GRM5 1968/4885DRD2 3634/4885DRD3 3704/4885
US-20100324009-A1 Substituted Sulfonamide Compounds SULT2A1, STS, SULT1A1 GRM5 1968/4885DRD2 3634/4885DRD3 3704/4885
US-20080153843-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS SULT2A1, STS, SULT1A1 GRM5 1968/4885DRD2 3634/4885DRD3 3704/4885

“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.