SCHEMBL3601245

SCHEMBL3601245

COc1ccc(CCn2c(C)c3c(=O)n(-c4nc5ccccc5s4)[nH]c3cc2=O)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 6/20 1.00
RAB9A P51151 4/20 1.00
L3MBTL1 Q9Y468 4/20 1.00
MEN1 O00255 4/20 1.00
KMT2A Q03164 4/20 1.00
POLB P06746 3/20 1.00
MAPT P10636 3/20 1.00
RECQL P46063 3/20 1.00
NPC1 O15118 2/20 1.00
USP2 O75604 2/20 1.00
THRB P10828 1/20 1.00
APEX1 P27695 1/20 1.00
NOX4 Q9NPH5 7/20 0.68
NPSR1 Q6W5P4 1/20 0.49
SLC11A2 P49281 3/20 0.47
SHMT2 P34897 1/20 0.46
TNF P01375 1/20 0.44
GAA P10253 1/20 0.44
NOD2 Q9HC29 1/20 0.44
NOD1 Q9Y239 1/20 0.44

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
SCHEMBL3611341 0.91 KDM4E (0.83) KDM4ERAB9AL3MBTL1MEN1KMT2A
SCHEMBL3609898 0.82 NOX4 (0.72) KDM4ERAB9AL3MBTL1MEN1KMT2A
SCHEMBL23493821 0.81 NOX4 (1.00) KDM4ERAB9AL3MBTL1MEN1KMT2A
SCHEMBL3609316 0.80 NOX4 (1.00) KDM4ERAB9AL3MBTL1MEN1KMT2A
SCHEMBL17131858 0.79 NOX4 (0.74) KDM4ERAB9AL3MBTL1MEN1KMT2A
SCHEMBL3612288 0.78 NOX4 (1.00) KDM4ERAB9AL3MBTL1MEN1KMT2A
SCHEMBL3606872 0.78 NOX4 (0.64) KDM4ERAB9AL3MBTL1MEN1KMT2A
SCHEMBL3606000 0.77 NOX4 (0.71) KDM4ERAB9AL3MBTL1MEN1KMT2A
SCHEMBL3618616 0.76 NOX4 (0.62) KDM4ERAB9AL3MBTL1MEN1KMT2A
SCHEMBL19607835 0.76 NOX4 (0.67) KDM4ERAB9AL3MBTL1MEN1KMT2A

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 25 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8389518-B2 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2013-03-05 US claimed
EP-2139477-B1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SA (CH) 2012-12-12 EP claimed
US-20100048560-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SA (CH) 2010-02-25 US claimed
EP-2139477-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYO TEX SA (CH) 2010-01-06 EP claimed
EP-2002835-A1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GenKyo Tex (CH) 2008-12-17 EP claimed
WO-2008113856-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYO TEX SA (CH) 2008-09-25 WO claimed
US-9073919-B2 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2015-07-07 US disclosed
US-9073919-B2 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2015-07-07 US disclosed
EP-2545918-B1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2014-08-06 EP disclosed
EP-2545918-B1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2014-08-06 EP disclosed
US-20130123256-A1 Pyrazolo Pyridine Derivatives as NADPH Oxidase Inhibitors GENKYOTEX SA (CH) 2013-05-16 US disclosed
US-20130123256-A1 Pyrazolo Pyridine Derivatives as NADPH Oxidase Inhibitors GENKYOTEX SA (CH) 2013-05-16 US disclosed
US-8389518-B2 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2013-03-05 US disclosed
US-20100048560-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SA (CH) 2010-02-25 US disclosed
US-20100048560-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SA (CH) 2010-02-25 US disclosed
EP-2139477-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYO TEX SA (CH) 2010-01-06 EP disclosed
EP-2002835-A1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GenKyo Tex (CH) 2008-12-17 EP disclosed
EP-2002835-A1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GenKyo Tex (CH) 2008-12-17 EP disclosed
WO-2008113856-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYO TEX SA (CH) 2008-09-25 WO disclosed
WO-2008113856-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYO TEX SA (CH) 2008-09-25 WO 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-20100048560-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS NOX1, NOX4, CYBB KDM4E 3416/4885RAB9A 2490/4885L3MBTL1 4817/4885
US-20130123256-A1 Pyrazolo Pyridine Derivatives as NADPH Oxidase Inhibitors NOX1, NOX4, CYBB KDM4E 3416/4885RAB9A 2490/4885L3MBTL1 4817/4885

“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.