SCHEMBL533130

SCHEMBL533130

COC(=O)c1sccc1S(=O)(=O)Nc1ccccc1

nearest known ligand 0.66

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.66
PPARD Q03181 1/20 0.66
PPARA Q07869 1/20 0.66
MAPT P10636 1/20 0.65
EDNRA P25101 7/20 0.57
POLB P06746 1/20 0.57
KMT2A Q03164 2/20 0.57
MEN1 O00255 1/20 0.57
CYP3A4 P08684 1/20 0.57
TSHR P16473 1/20 0.57
SLC10A6 Q3KNW5 1/20 0.53
LMNA P02545 2/20 0.51
CCR2 P41597 1/20 0.50
TAS2R8 Q9NYW2 1/20 0.50
KCNH2 Q12809 1/20 0.49

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
SCHEMBL12293573 0.88 MAPT (0.64) PPARGPPARDPPARAMAPTEDNRA
SCHEMBL12293583 0.87 MAPT (0.67) PPARGPPARDPPARAMAPTEDNRA
SCHEMBL12293576 0.87 MAPT (0.67) PPARGPPARDPPARAMAPTEDNRA
SCHEMBL12293606 0.87 MAPT (0.67) PPARGPPARDPPARAMAPTEDNRA
SCHEMBL12293571 0.87 MAPT (0.67) PPARGPPARDPPARAMAPTEDNRA
SCHEMBL12293577 0.86 MAPT (0.65) PPARGPPARDPPARAMAPTEDNRA
SCHEMBL12293569 0.86 MAPT (0.65) PPARGPPARDPPARAMAPTEDNRA
SCHEMBL3912876 0.86 KMT2A (0.73) PPARGPPARDPPARAMAPTEDNRA
SCHEMBL12293623 0.86 PPARG (0.58) PPARGPPARDPPARAMAPTEDNRA
SCHEMBL12293616 0.86 MEN1 (0.57) PPARGPPARDPPARAMAPTEDNRA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8895608-B2 Sulfonamide anti-viral compounds Kineta, Inc. (US) 2014-11-25 US disclosed
US-8895608-B2 Sulfonamide anti-viral compounds Kineta, Inc. (US) 2014-11-25 US disclosed
US-20130039945-A1 Anti-Viral Compounds Kineta, Inc. (US) 2013-02-14 US disclosed
US-20130039945-A1 Anti-Viral Compounds Kineta, Inc. (US) 2013-02-14 US disclosed
EP-2415760-A2 CCR-9 antagonists ENCYSIVE PHARMACEUTICALS, INC. (US) 2012-02-08 EP disclosed
EP-2415760-A2 CCR-9 antagonists ENCYSIVE PHARMACEUTICALS, INC. (US) 2012-02-08 EP disclosed
WO-2011133729-A2 ANTI-VIRAL COMPOUNDS Kineta, Inc. (US) 2011-10-27 WO disclosed
US-7579340-B2 Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists PFIZER INC (US) 2009-08-25 US disclosed
US-7579340-B2 Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists PFIZER INC (US) 2009-08-25 US disclosed
US-7579340-B2 Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists PFIZER INC (US) 2009-08-25 US disclosed
US-20070293503-A1 Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists ENCYSIVE PHARMACEUTICALS, INC. 2007-12-20 US disclosed
US-7288538-B2 Cardiovascular homeostasis through combination of direct neuronal control and systemic neurohormonal activation ENCYSIVE PHARMACEUTICALS, INC. (US) 2007-10-30 US disclosed
US-7288538-B2 Cardiovascular homeostasis through combination of direct neuronal control and systemic neurohormonal activation ENCYSIVE PHARMACEUTICALS, INC. (US) 2007-10-30 US disclosed
US-7288538-B2 Cardiovascular homeostasis through combination of direct neuronal control and systemic neurohormonal activation ENCYSIVE PHARMACEUTICALS, INC. (US) 2007-10-30 US disclosed
EP-1610753-A4 PHENYLENEDIAMINE UROTENSIN-II RECEPTOR ANTAGONISTS AND CCR-9 ANTAGONISTS ENCYSIVE PHARMACEUTICALS INC (US) 2007-07-04 EP disclosed
EP-1610753-A2 PHENYLENEDIAMINE UROTENSIN-II RECEPTOR ANTAGONISTS AND CCR-9 ANTAGONISTS ENCYSIVE PHARMACEUTICALS INC. (US) 2006-01-04 EP disclosed
US-20050049286-A1 Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists ENCYSIVE PHARMACEUTICALS INC. 2005-03-03 US disclosed
US-20040180892-A1 Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists ENCYSIVE PHARMACEUTICALS INC. 2004-09-16 US disclosed
WO-2004073634-A2 PHENYLENEDIAMINE UROTENSIN-II RECEPTOR ANTAGONISTS AND CCR-9 ANTAGONISTS ENCYSIVE PHARMACEUTICALS INC. (US) 2004-09-02 WO disclosed
WO-2004073634-A2 PHENYLENEDIAMINE UROTENSIN-II RECEPTOR ANTAGONISTS AND CCR-9 ANTAGONISTS ENCYSIVE PHARMACEUTICALS INC. (US) 2004-09-02 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 (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-20050049286-A1 Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists CCR9, CCR1, CCRL2 PPARG 2622/4885PPARD 970/4885PPARA 2515/4885
US-20040180892-A1 Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists CCR9, CCR1, CCRL2 PPARG 2622/4885PPARD 970/4885PPARA 2515/4885
US-20070293503-A1 Phenylenediamine urotensin-II receptor antagonists and CCR-9 antagonists CCR9, CCR1, CCRL2 PPARG 2622/4885PPARD 970/4885PPARA 2515/4885
US-20130039945-A1 Anti-Viral Compounds MAVS, EIF2AK2, IRF3 PPARG 2406/4885PPARD 2888/4885PPARA 3235/4885

“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.