SCHEMBL3606872

SCHEMBL3606872

CCC(C)Cn1c(C)c2c(=O)n(-c3nc4ccccc4s3)[nH]c2cc1=O

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX4 Q9NPH5 7/20 0.64
MAPT P10636 8/20 0.63
KDM4E B2RXH2 7/20 0.63
KMT2A Q03164 5/20 0.63
POLB P06746 5/20 0.63
RECQL P46063 4/20 0.63
RAB9A P51151 4/20 0.63
MEN1 O00255 4/20 0.63
USP2 O75604 3/20 0.63
NPC1 O15118 3/20 0.63
L3MBTL1 Q9Y468 3/20 0.63
THRB P10828 2/20 0.63
APEX1 P27695 1/20 0.63
TDP1 Q9NUW8 5/20 0.53
SHMT2 P34897 1/20 0.50
SLC11A2 P49281 2/20 0.47
ALDH1A1 P00352 4/20 0.45
LMNA P02545 3/20 0.45
HSD17B10 Q99714 3/20 0.45
ALOX12 P18054 1/20 0.45

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 0.82 KDM4E (0.83) NOX4MAPTKDM4EKMT2APOLB
SCHEMBL19607835 0.80 NOX4 (0.67) NOX4MAPTKDM4EKMT2APOLB
SCHEMBL17131858 0.79 NOX4 (0.74) NOX4MAPTKDM4EKMT2APOLB
SCHEMBL3609898 0.78 NOX4 (0.72) NOX4MAPTKDM4EKMT2APOLB
SCHEMBL3612288 0.78 NOX4 (1.00) NOX4MAPTKDM4EKMT2APOLB
SCHEMBL23493821 0.78 NOX4 (1.00) NOX4MAPTKDM4EKMT2APOLB
SCHEMBL3601245 0.78 KDM4E (1.00) NOX4MAPTKDM4EKMT2APOLB
SCHEMBL3606000 0.77 NOX4 (0.71) NOX4MAPTKDM4EKMT2APOLB
SCHEMBL3609316 0.77 NOX4 (1.00) NOX4MAPTKDM4EKMT2APOLB
SCHEMBL3618616 0.76 NOX4 (0.62) NOX4MAPTKDM4EKMT2APOLB

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 20 patents. 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-2002835-A1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GenKyo Tex (CH) 2008-12-17 EP 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-8389518-B2 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2013-03-05 US disclosed
EP-2545918-A1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2013-01-16 EP disclosed
EP-2139477-B1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SA (CH) 2012-12-12 EP 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
US-20100048560-A1 PYRAZOLO PYRIDINE DERIVATIVES AS NADPH OXIDASE INHIBITORS GENKYOTEX SA (CH) 2010-02-25 US 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

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 NOX4 2/4885MAPT 1500/4885KDM4E 3416/4885
US-20130123256-A1 Pyrazolo Pyridine Derivatives as NADPH Oxidase Inhibitors NOX1, NOX4, CYBB NOX4 2/4885MAPT 1500/4885KDM4E 3416/4885

“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.