SCHEMBL3410165

SCHEMBL3410165

CCc1ccc(Cc2cn(S(=O)(=O)c3ccccc3)c3cccc(Br)c23)cc1

nearest known ligand 0.54

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.54
DRD2 P14416 2/20 0.43
HTR1A P08908 1/20 0.43
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
HTR1F P30939 1/20 0.43
HTR7 P34969 1/20 0.43
DRD3 P35462 1/20 0.43
HTR2A P28223 1/20 0.41
ALK Q9UM73 1/20 0.40
SLC5A2 P31639 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
SCHEMBL3413346 0.82 HTR6 (0.46) HTR6DRD2HTR2A
SCHEMBL19216921 0.79 HTR6 (0.52) HTR6HTR1DHTR1BDRD3ALK
SCHEMBL3052460 0.79 HTR6 (0.64) HTR6DRD2HTR1AHTR1DHTR1B
SCHEMBL3619076 0.76 HTR6 (0.52) HTR6
SCHEMBL31634100 0.73 HTR6 (0.49) HTR6
SCHEMBL1973755 0.71 HTR6 (0.51) HTR6DRD2HTR1AHTR1DHTR1B
SCHEMBL4797587 0.71 AKR1C3 (0.48) HTR6
SCHEMBL4782100 0.71 HTR6 (0.47) HTR6DRD2HTR1AHTR7HTR2A
SCHEMBL4367746 0.71 HTR6 (0.51) HTR6HTR1DHTR1BDRD3ALK
SCHEMBL3204417 0.70 HTR6 (1.00) 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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7816328-B2 Substituted fused heterocyclic C-glycosides JANSSEN PHARMACEUTICA NV (BE) 2010-10-19 US disclosed
US-20100004160-A1 SUBSTITUTED FUSED HETEROCYCLIC C-GLYCOSIDES RYBCZYNSKI PHILIP 2010-01-07 US disclosed
US-20090105162-A1 SUBSTITUTED FUSED HETEROCYCLIC C-GLYCOSIDES RYBCZYNSKI PHILIP 2009-04-23 US disclosed
US-7482330-B2 Substituted fused heterocyclic C-glycosides JANSSEN PHARMACEUTICA N.V. (BE) 2009-01-27 US disclosed
US-20060229260-A1 Substituted fused heterocyclic C-glycosides Tanabe Pharma Corporation (JP) 2006-10-12 US disclosed
US-7094763-B2 Substituted fused heterocyclic C-glycosides JANSSEN PHARACEUTICA, N.V. (BE) 2006-08-22 US disclosed
US-20050037980-A1 Substituted fused heterocyclic C-glycosides JANSSEN PHARMACEUTICA N.V. (BE) 2005-02-17 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 (4 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-20100004160-A1 SUBSTITUTED FUSED HETEROCYCLIC C-GLYCOSIDES UGCG, UGGT1, GCG HTR6 4328/4885DRD2 4433/4885HTR1A 4358/4885
US-20060229260-A1 Substituted fused heterocyclic C-glycosides UGCG, UGGT1, GCG HTR6 4328/4885DRD2 4433/4885HTR1A 4358/4885
US-20090105162-A1 SUBSTITUTED FUSED HETEROCYCLIC C-GLYCOSIDES UGCG, UGGT1, GCG HTR6 4328/4885DRD2 4433/4885HTR1A 4358/4885
US-20050037980-A1 Substituted fused heterocyclic C-glycosides UGCG, UGGT1, GCG HTR6 4328/4885DRD2 4433/4885HTR1A 4358/4885

“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.