SCHEMBL4472468

SCHEMBL4472468

COc1ccc(S(=O)(=O)n2cc(N)c3cc(OC)ccc32)cc1

nearest known ligand 0.61

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 18/20 0.61
PPARG P37231 2/20 0.60
PPARD Q03181 2/20 0.60
PPARA Q07869 2/20 0.60
HTR1A P08908 2/20 0.55
HTR2A P28223 3/20 0.54
HTR7 P34969 3/20 0.54
DRD2 P14416 2/20 0.54
HTR1D P28221 1/20 0.53
HTR1B P28222 1/20 0.53
HTR1E P28566 1/20 0.53
HTR1F P30939 1/20 0.53
DRD3 P35462 1/20 0.53

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
SCHEMBL3035871 0.81 HTR6 (0.59) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL13869015 0.81 HTR6 (0.59) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL950479 0.80 PPARG (0.73) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL4775130 0.80 HTR6 (0.71) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL4480645 0.80 HTR6 (0.58) HTR6PPARGPPARDPPARAHTR1A
Hydrochloric Acid SCHEMBL7492450 0.80 HTR6 (0.85) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL13302272 0.79 HTR6 (0.62) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL2009670 0.79 HTR6 (0.51) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL13240012 0.78 HTR6 (0.68) HTR6PPARGPPARDPPARAHTR1A
SCHEMBL4472531 0.78 PPARG (0.66) HTR6PPARGPPARDPPARAHTR1A

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-7531568-B2 PPAR active compounds PLEXXIKON, INC. (US) 2009-05-12 US disclosed
US-7531568-B2 PPAR active compounds PLEXXIKON, INC. (US) 2009-05-12 US disclosed
US-7531568-B2 PPAR active compounds PLEXXIKON, INC. (US) 2009-05-12 US disclosed
EP-1819673-A2 INDOLE DERIVATIVES FOR USE AS PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2007-08-22 EP disclosed
WO-2006060456-A2 INDOLE DERIVATIVES FOR USE AS PPAR PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2006-06-08 WO disclosed
US-20060116416-A1 PPAR active compounds PLEXXIKON, INC 2006-06-01 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 (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-20060116416-A1 PPAR active compounds PPARG, PPARA, PPARD HTR6 1985/4885PPARG 1/4885PPARD 3/4885

“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.