SCHEMBL1972909

SCHEMBL1972909

COc1ccc2c(c1)c(C)cn2S(=O)(=O)c1ccc(C(C)C)c(OC2CCN(C)CC2)c1

nearest known ligand 0.53

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 7/20 0.53
CYP2D6 P10635 6/20 0.53
HTR2A P28223 3/20 0.53
KCNH2 Q12809 2/20 0.53
DRD2 P14416 2/20 0.53
SLC6A2 P23975 2/20 0.53
HTR2C P28335 2/20 0.53
HTR7 P34969 2/20 0.53
HRH1 P35367 2/20 0.53
ADRA1B P35368 2/20 0.53
SLC6A3 Q01959 2/20 0.53
SLC6A4 P31645 1/20 0.53
HTR6 P50406 17/20 0.49

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
SCHEMBL1972394 0.89 KCNH2 (0.62) CYP3A4CYP2D6HTR2AKCNH2DRD2
SCHEMBL1975024 0.88 CYP3A4 (0.59) CYP3A4CYP2D6HTR2AKCNH2DRD2
SCHEMBL1974651 0.84 HTR6 (0.50) CYP3A4CYP2D6HTR2AHTR6
SCHEMBL2235402 0.79 KCNH2 (0.75) CYP3A4CYP2D6HTR2AKCNH2DRD2
SCHEMBL1971693 0.77 HTR6 (0.53) CYP3A4CYP2D6HTR2ADRD2HTR7
SCHEMBL1975081 0.77 HTR6 (0.53) CYP3A4CYP2D6HTR2AKCNH2DRD2
SCHEMBL2233862 0.75 KCNH2 (0.63) CYP3A4CYP2D6HTR2AKCNH2DRD2
SCHEMBL1972270 0.74 HTR6 (0.56) KCNH2HTR6
SCHEMBL1971033 0.74 HTR6 (0.56) HTR6
SCHEMBL1975418 0.72 HTR6 (0.54) HTR6

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003670-B2 Aminoalkoxy aryl sulfonamide compounds and their use as 5-HT6 ligands SUVEN LIFE SCIENCES LIMITED (IN) 2011-08-23 US disclosed
EP-2155674-B1 AMINOALKOXY ARYL SULFONAMIDE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2011-06-22 EP disclosed
US-20100087484-A1 AMINOALKOXY ARYL SULFONAMIDE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2010-04-08 US disclosed
EP-2155674-A1 AMINOALKOXY ARYL SULFONAMIDE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS Suven Life Sciences Limited (IN) 2010-02-24 EP disclosed
WO-2008136017-A1 AMINOALKOXY ARYL SULFONAMIDE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2008-11-13 WO 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 (1 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-20100087484-A1 AMINOALKOXY ARYL SULFONAMIDE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS HTR6, HTR5A, HTR1B CYP3A4 478/4885CYP2D6 40/4885HTR2A 7/4885

“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.