SCHEMBL2169945

SCHEMBL2169945

CN1CCC(Nc2cc(NS(=O)(=O)c3ccc(Br)cc3)ccc2Cl)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.50
DRD2 P14416 5/20 0.50
HTR2C P28335 5/20 0.50
DRD3 P35462 5/20 0.50
CYP3A4 P08684 4/20 0.50
HTR2A P28223 4/20 0.50
CYP2D6 P10635 3/20 0.50
CYP1A2 P05177 2/20 0.50
CYP2C19 P33261 2/20 0.50
HTR1A P08908 1/20 0.50
HTR1D P28221 1/20 0.50
HTR1B P28222 1/20 0.50
HTR1E P28566 1/20 0.50
HTR1F P30939 1/20 0.50
HTR7 P34969 1/20 0.50
ADRA1B P35368 1/20 0.50
HTR2B P41595 1/20 0.50
HTR4 Q13639 1/20 0.50
MAPT P10636 2/20 0.46
NPSR1 Q6W5P4 2/20 0.46

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
SCHEMBL2183002 0.90 CYP3A4 (0.49) HTR6DRD2HTR2CDRD3CYP3A4
SCHEMBL2169741 0.89 HSD17B3 (0.49) HTR6DRD2HTR2CDRD3CYP3A4
SCHEMBL2183994 0.89 CYP3A4 (0.49) HTR6DRD2HTR2CDRD3CYP3A4
SCHEMBL2169936 0.88 HTR6 (0.49) HTR6DRD2HTR2CDRD3CYP3A4
Hydrochloric Acid SCHEMBL6118475 0.88 CYP3A4 (0.48) HTR6DRD2HTR2CDRD3CYP3A4
SCHEMBL2169701 0.84 HTR6 (0.47) HTR6DRD2HTR2CDRD3CYP3A4
SCHEMBL6118587 0.83 CYP3A4 (0.51) HTR6CYP3A4CYP2D6HTR1AHTR7
SCHEMBL2169909 0.82 CYP3A4 (0.54) HTR6DRD2HTR2CDRD3CYP3A4
SCHEMBL2172076 0.82 HSD17B2 (0.52) HTR6DRD2HTR2CDRD3CYP3A4
SCHEMBL2185914 0.81 ALDH1A1 (0.50) HTR6HTR2CCYP3A4HTR2AHTR1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2346847-B1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2013-05-15 EP claimed
US-20120129816-A1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2012-05-24 US claimed
EP-2346847-B1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LTD (IN) 2013-05-15 EP disclosed
US-8404720-B2 Aryl sulfonamide amine compounds and their use as 5-HT6 ligands SUVEN LIFE SCIENCES LIMITED (IN) 2013-03-26 US disclosed
US-20120129816-A1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2012-05-24 US disclosed
EP-2346847-A1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS Suven Life Sciences Limited (IN) 2011-07-27 EP disclosed
WO-2010032258-A1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS SUVEN LIFE SCIENCES LIMITED (IN) 2010-03-25 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-20120129816-A1 ARYL SULFONAMIDE AMINE COMPOUNDS AND THEIR USE AS 5-HT6 LIGANDS HTR6, HTR1A, HTR5A HTR6 1/4885DRD2 151/4885HTR2C 6/4885

“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.