SCHEMBL3531209

SCHEMBL3531209

NS(=O)(=O)c1cccc(Br)c1Cl

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 9/20 0.61
CA1 P00915 7/20 0.61
CA4 P22748 4/20 0.61
CA6 P23280 4/20 0.61
CA9 Q16790 5/20 0.45
CA7 P43166 4/20 0.45
CA12 O43570 3/20 0.45
CA5A P35218 3/20 0.45
CA5B Q9Y2D0 3/20 0.45
CYP2C9 P11712 2/20 0.45
CA14 Q9ULX7 2/20 0.45
PTGES2 Q9H7Z7 5/20 0.45
CDK2 P24941 1/20 0.44
PLCG1 P19174 1/20 0.42
LMNA P02545 3/20 0.41
KDM4E B2RXH2 1/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
MAPK1 P28482 1/20 0.40

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
SCHEMBL10593744 0.86 CA2 (0.52) CA2CA1CA4CA6CA9
SCHEMBL25294557 0.83 CA2 (0.45) CA2CA1CA4CA6CA9
SCHEMBL31152920 0.83 CA2 (0.45) CA2CA1CA4CA6CA9
SCHEMBL2781407 0.81 CA1 (0.43) CA2CA1CA4CA6PTGES2
SCHEMBL27883806 0.81 CA1 (0.43) CA2CA1CA4CA6PTGES2
SCHEMBL29578190 0.80 PTGES2 (0.64) CA2CA1CA4CA6CA9
SCHEMBL742940 0.80 PTGES2 (0.64) CA2CA1CA4CA6CA9
SCHEMBL3533544 0.80 CA2 (0.47) CA2CA1CA4CA6CA9
SCHEMBL25301662 0.78 CA2 (0.45) CA2CA1CA4CA6CA9
SCHEMBL28335651 0.78 CA2 (0.61) CA2CA1CA4CA6CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250109118-A1 HETEROCYCLIC COMPOUNDS AS SHP2 INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOMED HOLDINGS LTD. (KY) 2025-04-03 US disclosed
WO-2023122938-A1 HETEROCYCLIC COMPOUNDS AS SHP2 INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOMED HOLDINGS LTD. (KY) 2023-07-06 WO disclosed
WO-2023122938-A1 HETEROCYCLIC COMPOUNDS AS SHP2 INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF JS INNOMED HOLDINGS LTD. (KY) 2023-07-06 WO disclosed
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 (3 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-20250109118-A1 HETEROCYCLIC COMPOUNDS AS SHP2 INHIBITORS, COMPOSITIONS COMPRISING THE HETEROCYCLIC COMPOUND, AND METHODS OF USE THEREOF PTPN1, PTPN5, PTPN13 CA2 883/4885CA1 1423/4885CA4 1327/4885
US-20090239856-A1 Use of Pyrrolopyridine Compounds for Activating PPAR Receptors and Treatment of Conditions Involving Such Receptors PPARD, PPARA, PPARG CA2 3289/4885CA1 4506/4885CA4 4520/4885
US-20080200495-A1 Pyrrolopyridine Compounds, Method of Making Them and Uses Thereof LIPG, PCSK9, PNLIP CA2 3468/4885CA1 4518/4885CA4 3900/4885

“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.