SCHEMBL3533574

SCHEMBL3533574

CC(=O)Nc1nc2ccc(S(=O)(=O)n3c(COC(C)C(=O)O)cc4nc(Cl)ccc43)cc2s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.48
DYRK1A Q13627 4/20 0.43
FSCN1 Q16658 1/20 0.43
ALDH1A1 P00352 4/20 0.42
GAA P10253 1/20 0.42
CLK1 P49759 1/20 0.41
TP53 P04637 2/20 0.41
PPARG P37231 2/20 0.41
PPARD Q03181 2/20 0.41
BLM P54132 1/20 0.41
MEN1 O00255 3/20 0.40
KMT2A Q03164 3/20 0.40
HTT P42858 2/20 0.40
PPARA Q07869 1/20 0.40
LMNA P02545 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
NPC1 O15118 1/20 0.39
CYP1A2 P05177 1/20 0.39
CYP3A4 P08684 1/20 0.39
CYP2C19 P33261 1/20 0.39

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
SCHEMBL3532199 0.87 PPARG (0.53) ALDH1A1TP53PPARGPPARDMEN1
SCHEMBL3533939 0.84 PPARG (0.53) ALDH1A1PPARGPPARDPPARAL3MBTL1
SCHEMBL3531786 0.83 PPARG (0.60) POLBDYRK1AFSCN1TP53PPARG
SCHEMBL3531264 0.82 PPARG (0.50) ALDH1A1PPARGPPARDPPARA
SCHEMBL3532175 0.80 PPARG (0.43) ALDH1A1GAAPPARGPPARDHTT
SCHEMBL3531013 0.80 PPARG (0.43) ALDH1A1GAAPPARGPPARDHTT
SCHEMBL3526787 0.77 PPARG (0.69) PPARGPPARDMEN1KMT2AHTT
SCHEMBL3524662 0.75 PPARG (0.54) POLBDYRK1AFSCN1GAATP53
SCHEMBL3530671 0.73 PPARG (0.48) ALDH1A1PPARGPPARDPPARA
SCHEMBL3529792 0.73 PPARG (0.69) POLBDYRK1AFSCN1PPARGPPARD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7728002-B2 Use of pyrrolopyridine compounds for activating PPAR receptors and treatment of conditions involving such receptors LABORATOIRES FOURNIER S.A. (FR) 2010-06-01 US disclosed
US-20090239856-A1 Use of Pyrrolopyridine Compounds for Activating PPAR Receptors and Treatment of Conditions Involving Such Receptors LABORATOIRES FOURNIER S.A. (FR) 2009-09-24 US disclosed
US-7557122-B2 Pyrrolopyridine compounds, method of making them and uses thereof LABORATOIRES FOURNIER S.A. (FR) 2009-07-07 US disclosed
US-20080200495-A1 Pyrrolopyridine Compounds, Method of Making Them and Uses Thereof LABORATOIRES FOURNIER S.A. (FR) 2008-08-21 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-20090239856-A1 Use of Pyrrolopyridine Compounds for Activating PPAR Receptors and Treatment of Conditions Involving Such Receptors PPARD, PPARA, PPARG POLB 1219/4885DYRK1A 2650/4885FSCN1 4881/4885
US-20080200495-A1 Pyrrolopyridine Compounds, Method of Making Them and Uses Thereof LIPG, PCSK9, PNLIP POLB 1293/4885DYRK1A 3288/4885FSCN1 4704/4885

“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.