SCHEMBL3526689

SCHEMBL3526689

CC(=O)N1CCc2cc(S(=O)(=O)n3c(CCC(=O)O)cc4nc(Cl)ccc43)ccc21

nearest known ligand 0.53

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 1/20 0.45
CYP2C9 P11712 1/20 0.44
PTPN11 Q06124 4/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
PPARG P37231 1/20 0.43
PPARD Q03181 1/20 0.43
PPARA Q07869 1/20 0.43
POLB P06746 2/20 0.43
LMNA P02545 2/20 0.43
MAPT P10636 1/20 0.43
THRB P10828 1/20 0.43
TP53 P04637 1/20 0.43
TNF P01375 1/20 0.42
NOD2 Q9HC29 1/20 0.42
NOD1 Q9Y239 1/20 0.42

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
SCHEMBL3532770 0.95 PPARG (0.47) MAPK1PTPN11PPARGPPARDPPARA
SCHEMBL3523593 0.86 PPARG (0.62) PTPN11PPARGPPARDPPARA
SCHEMBL3522953 0.81 PPARG (0.65) PPARGPPARDPPARA
SCHEMBL3527552 0.80 PPARG (0.57) MAPK1CYP2C9PTPN11SMN1; SMN2PPARG
SCHEMBL3533721 0.80 PPARG (0.46) PPARGPPARDPPARA
SCHEMBL3531387 0.79 PPARG (0.60) PPARGPPARDPPARATHRB
SCHEMBL3535429 0.78 PPARG (0.68) PPARGPPARDPPARA
SCHEMBL3533266 0.77 PPARG (0.53) PPARGPPARDPPARA
SCHEMBL27732238 0.77 PPARG (0.67) PPARGPPARDPPARA
SCHEMBL3523515 0.77 USP2 (0.51) PPARGPPARDPPARALMNATHRB

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 MAPK1 886/4885CYP2C9 2384/4885PTPN11 1951/4885
US-20080200495-A1 Pyrrolopyridine Compounds, Method of Making Them and Uses Thereof LIPG, PCSK9, PNLIP MAPK1 956/4885CYP2C9 270/4885PTPN11 786/4885

“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.