SCHEMBL3033157

SCHEMBL3033157

Cc1ccc2c(c1)c(CCC(=O)O)cn2S(=O)(=O)c1ccccc1

nearest known ligand 0.65

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PPARG P37231 3/20 0.65
PPARA Q07869 3/20 0.65
PPARD Q03181 2/20 0.65
HTR6 P50406 15/20 0.57
HTR1A P08908 2/20 0.53
DRD2 P14416 2/20 0.53
HTR1D P28221 2/20 0.53
HTR1B P28222 2/20 0.53
HTR1F P30939 2/20 0.53
HTR7 P34969 2/20 0.53
DRD3 P35462 2/20 0.53
HTR1E P28566 1/20 0.53
BRD4 O60885 1/20 0.51
PLA2G4A P47712 1/20 0.50

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
SCHEMBL3579600 0.89 PPARG (0.64) PPARGPPARAPPARDHTR6HTR1A
SCHEMBL3029511 0.86 PPARG (0.63) PPARGPPARAPPARDHTR6HTR1A
SCHEMBL3034463 0.86 PPARG (0.62) PPARGPPARAPPARDHTR6HTR1A
SCHEMBL3029070 0.86 PPARG (0.62) PPARGPPARAPPARDHTR6HTR1A
SCHEMBL3029775 0.86 PPARG (0.62) PPARGPPARAPPARDHTR6HTR1A
SCHEMBL3036278 0.86 PPARG (0.62) PPARGPPARAPPARDHTR6HTR1A
SCHEMBL3034510 0.85 PPARG (0.89) PPARGPPARAPPARDHTR6HTR1A
SCHEMBL3033927 0.85 HTR6 (0.71) PPARGPPARAPPARDHTR6HTR1A
SCHEMBL13368605 0.83 HTR6 (0.55) HTR6HTR1ADRD2HTR1DHTR1B
SCHEMBL352303 0.83 PPARG (0.90) PPARGPPARAPPARDHTR6HTR1A

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 47 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1648867-B1 PPAR ACTIVE COMPOUNDS PLEXXIKON INC (US) 2013-09-04 EP claimed
CN-102875441-A Plexxikon inc PLEXXIKON INC 2013-01-16 CN claimed
US-7476746-B2 PPAR active compounds PLEXXIKON, INC. (US) 2009-01-13 US claimed
US-20080045581-A1 PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. 2008-02-21 US claimed
US-7202266-B2 PPAR active compounds PLEXXIKON, INC. (US) 2007-04-10 US claimed
EP-1648867-B1 PPAR ACTIVE COMPOUNDS PLEXXIKON INC (US) 2013-09-04 EP disclosed
EP-1648867-B1 PPAR ACTIVE COMPOUNDS PLEXXIKON INC (US) 2013-09-04 EP disclosed
US-8367828-B2 PPAR active compounds PLEXXIKON INC. (US) 2013-02-05 US disclosed
US-8367828-B2 PPAR active compounds PLEXXIKON INC. (US) 2013-02-05 US disclosed
US-8367828-B2 PPAR active compounds PLEXXIKON INC. (US) 2013-02-05 US disclosed
CN-102875441-A Plexxikon inc PLEXXIKON INC 2013-01-16 CN disclosed
US-20100210036-A1 PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. 2010-08-19 US disclosed
US-20070149603-A1 PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. 2007-06-28 US disclosed
US-7202266-B2 PPAR active compounds PLEXXIKON, INC. (US) 2007-04-10 US disclosed
US-7202266-B2 PPAR active compounds PLEXXIKON, INC. (US) 2007-04-10 US disclosed
CN-1845898-A PPAR active compounds PLEXXIKON INC (US) 2006-10-11 CN disclosed
EP-1648867-A1 PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2006-04-26 EP disclosed
US-20050288354-A1 PPAR active compounds PLEXXIKON, INC. 2005-12-29 US disclosed
US-20050038246-A1 PPAR active compounds PLEXXIKON, INC. 2005-02-17 US disclosed
WO-2005009958-A1 PPAR ACTIVE COMPOUNDS PLEXXIKON, INC. (US) 2005-02-03 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 (5 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-20050038246-A1 PPAR active compounds PPARG, PPARD, PPARA PPARG 1/4885PPARA 3/4885PPARD 2/4885
US-20080045581-A1 PPAR ACTIVE COMPOUNDS PPARG, PPARD, PPARA PPARG 1/4885PPARA 3/4885PPARD 2/4885
US-20050288354-A1 PPAR active compounds PPARG, PPARD, PPARA PPARG 1/4885PPARA 3/4885PPARD 2/4885
US-20070149603-A1 PPAR ACTIVE COMPOUNDS PPARG, PPARD, PPARA PPARG 1/4885PPARA 3/4885PPARD 2/4885
US-20100210036-A1 PPAR ACTIVE COMPOUNDS PPARG, PPARD, PPARA PPARG 1/4885PPARA 3/4885PPARD 2/4885

“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.