SCHEMBL3534519

SCHEMBL3534519

NS(=O)(=O)c1ccc(I)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 16/20 0.48
CA2 P00918 16/20 0.48
CA9 Q16790 9/20 0.48
CA12 O43570 8/20 0.48
CA7 P43166 8/20 0.48
CA6 P23280 7/20 0.48
CA4 P22748 6/20 0.48
CA5A P35218 5/20 0.48
CA14 Q9ULX7 5/20 0.48
CA5B Q9Y2D0 5/20 0.48
CA3 P07451 3/20 0.48
CA13 Q8N1Q1 6/20 0.43
CISD1 Q9NZ45 1/20 0.43
LMNA P02545 1/20 0.42
CYP2C9 P11712 1/20 0.42
POLB P06746 1/20 0.42
APEX1 P27695 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TET2 Q6N021 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
SCHEMBL30016544 0.83 CA1 (0.48) CA1CA2CA9CA12CA7
SCHEMBL26386090 0.79 CCR2 (0.47) LMNAL3MBTL1IDO1
SCHEMBL29587590 0.78 CA1 (0.53) CA1CA2CA9CA12CA7
SCHEMBL962913 0.78 CA1 (0.53) CA1CA2CA9CA12CA7
SCHEMBL3781004 0.77 CA2 (0.50) CA1CA2CA9CA12CA7
SCHEMBL1803685 0.77 CA1 (0.50) CA1CA2CA9CA12CA7
SCHEMBL1805099 0.77 CA1 (0.50) CA1CA2CA9CA12CA7
SCHEMBL1383117 0.77 CA1 (0.55) CA1CA2CA9CA12CA7
SCHEMBL1804853 0.76 CA1 (0.46) CA1CA2CA9CA12CA7
SCHEMBL8360359 0.75 PDIA6 (0.51) CA1CA2CA9CA12CA7

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 CA1 4506/4885CA2 3289/4885CA9 4621/4885
US-20080200495-A1 Pyrrolopyridine Compounds, Method of Making Them and Uses Thereof LIPG, PCSK9, PNLIP CA1 4518/4885CA2 3468/4885CA9 3204/4885

“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.