SCHEMBL4480245

SCHEMBL4480245

CCCN1CCN(c2ccc3c(S(=O)(=O)c4ccccc4)c[nH]c3n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.49
MET P08581 1/20 0.46
DRD2 P14416 7/20 0.42
DRD3 P35462 5/20 0.41
SLC6A2 P23975 4/20 0.41
HTR2A P28223 4/20 0.41
SIGMAR1 Q99720 1/20 0.40
HTR2C P28335 1/20 0.40

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
SCHEMBL4479103 0.82 HTR6 (0.57) HTR6MET
SCHEMBL4483917 0.80 HTR6 (0.48) HTR6METDRD2DRD3SIGMAR1
SCHEMBL5203323 0.77 HTR6 (0.80) HTR6DRD2DRD3SLC6A2HTR2A
SCHEMBL4490838 0.72 SLC6A2 (0.52) HTR6DRD2SLC6A2HTR2AHTR2C
SCHEMBL5879489 0.70 DRD2 (0.47) HTR6DRD2DRD3SIGMAR1HTR2C
SCHEMBL3323296 0.69 CASP1 (0.45) HTR6DRD2DRD3SLC6A2HTR2A
SCHEMBL5200852 0.68 HTR6 (0.77) HTR6DRD2DRD3
SCHEMBL4484018 0.67 HTR6 (0.48) HTR6DRD2DRD3HTR2ASIGMAR1
SCHEMBL3949549 0.67 DRD3 (0.53) HTR6DRD2DRD3SIGMAR1HTR2C
SCHEMBL4480373 0.67 HTR6 (0.56) HTR6METDRD2SLC6A2HTR2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7259165-B2 Heterocyclyl-3-sulfonylazaindole or-azaindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-08-21 US claimed
US-20040167030-A1 Heterocyclyl-3-sulfonylazaindole or-azaindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH 2004-08-26 US claimed
US-7576087-B2 Heterocyclyl-3-sulfonylazaindole or -azaindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2009-08-18 US disclosed
US-20080015201-A1 Heterocyclyl-3-sulfonylazaindole or -azaindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2008-01-17 US disclosed
US-7259165-B2 Heterocyclyl-3-sulfonylazaindole or-azaindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH (US) 2007-08-21 US disclosed
US-20040167030-A1 Heterocyclyl-3-sulfonylazaindole or-azaindazole derivatives as 5-hydroxytryptamine-6 ligands WYETH 2004-08-26 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 (2 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-20040167030-A1 Heterocyclyl-3-sulfonylazaindole or-azaindazole derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR2C HTR6 1/4885MET 1084/4885DRD2 120/4885
US-20080015201-A1 Heterocyclyl-3-sulfonylazaindole or -azaindazole derivatives as 5-hydroxytryptamine-6 ligands HTR6, HTR5A, HTR2C HTR6 1/4885MET 1152/4885DRD2 108/4885

“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.