SCHEMBL3536720

SCHEMBL3536720

O=S(=O)(Nc1ccc(Cl)nc1I)c1ccc2ncccc2c1

nearest known ligand 0.52

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.52
LMNA P02545 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
PIK3CA P42336 3/20 0.50
SLC40A1 Q9NP59 5/20 0.47
GLO1 Q04760 4/20 0.47
MEN1 O00255 4/20 0.47
KMT2A Q03164 4/20 0.47
TDP1 Q9NUW8 3/20 0.47
AGTR1 P30556 1/20 0.45
NMT1 P30419 1/20 0.43
POLB P06746 1/20 0.42
NAMPT P43490 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL3532837 0.79 GLO1 (0.57) ALDH1A1LMNAPIK3CAGLO1MEN1
SCHEMBL3535146 0.76 SLC40A1 (0.61) PIK3CASLC40A1GLO1MEN1KMT2A
SCHEMBL3533105 0.76 SLC40A1 (0.55) SLC40A1GLO1KMT2ACYP2C19
SCHEMBL3534093 0.76 ATM (0.62) ALDH1A1SLC40A1MEN1KMT2ATDP1
SCHEMBL9930803 0.75 CCR2 (0.67) LMNAGLO1TDP1
SCHEMBL6981076 0.74 ALDH1A1 (0.76) ALDH1A1LMNASMN1; SMN2PIK3CASLC40A1
SCHEMBL3530032 0.73 APP (0.42) ALDH1A1SLC40A1
SCHEMBL3535998 0.72 NFE2L2 (0.61) ALDH1A1LMNASLC40A1GLO1
SCHEMBL3528452 0.72 CYP2C9 (0.59) ALDH1A1LMNASMN1; SMN2KMT2ACYP2C9
SCHEMBL3529882 0.72 GLO1 (0.54) ALDH1A1LMNASMN1; SMN2GLO1MEN1

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 5 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
EP-1919474-B1 PYRROLOPYRIDINE DERIVATIVES AND USE OF SAME AS PPAR RECEPTOR MODULATORS FOURNIER LAB SA (FR) 2009-08-05 EP 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 ALDH1A1 1314/4885LMNA 2198/4885SMN1; SMN2 3212/4885
US-20080200495-A1 Pyrrolopyridine Compounds, Method of Making Them and Uses Thereof LIPG, PCSK9, PNLIP ALDH1A1 1350/4885LMNA 2360/4885SMN1; SMN2 2484/4885

“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.