SCHEMBL3598809

SCHEMBL3598809

Cc1cccc(Cn2c3cc(=O)n(CCc4c[nH]c5ccccc45)c(C)c3c(=O)n2-c2ccccc2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOX4 Q9NPH5 3/20 0.45
BCHE P06276 2/20 0.41
ACHE P22303 2/20 0.41
MAPT P10636 3/20 0.41
MEN1 O00255 1/20 0.41
ALDH1A1 P00352 1/20 0.41
KMT2A Q03164 1/20 0.41
CDK4 P11802 1/20 0.39
CCND1 P24385 1/20 0.39
GAA P10253 1/20 0.39
APP P05067 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38
HDAC11 Q96DB2 1/20 0.38
HDAC8 Q9BY41 1/20 0.38
HDAC6 Q9UBN7 1/20 0.38
TP53 P04637 1/20 0.38
HTR2A P28223 1/20 0.38
GPR18 Q14330 3/20 0.38
CNR2 P34972 2/20 0.38

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
SCHEMBL3604643 0.88 NOX4 (0.45) NOX4ALDH1A1CDK4CCND1HTR2A
SCHEMBL13980201 0.82 NOX4 (0.42) NOX4MAPTMEN1ALDH1A1KMT2A
SCHEMBL3612480 0.74 NOX4 (0.70) NOX4MAPTMEN1KMT2AGAA
SCHEMBL3612980 0.71 NOX4 (0.42) NOX4BCHEMEN1ALDH1A1KMT2A
SCHEMBL13503059 0.68 MAPT (0.42) NOX4BCHEACHEMAPTMEN1
SCHEMBL19607842 0.67 NOX4 (0.59) NOX4ALDH1A1
SCHEMBL19607961 0.67 NOX4 (0.58) NOX4MAPTMEN1ALDH1A1KMT2A
SCHEMBL21399641 0.64 MEN1 (0.68) BCHEACHEMAPTMEN1ALDH1A1
SCHEMBL8529611 0.63 RGS4 (0.58) ACHEMAPTMEN1ALDH1A1KMT2A
SCHEMBL3609316 0.62 NOX4 (1.00) NOX4MAPTMEN1ALDH1A1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9073919-B2 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2015-07-07 US claimed
EP-2545918-B1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2014-08-06 EP claimed
US-20130123256-A1 Pyrazolo Pyridine Derivatives as NADPH Oxidase Inhibitors GENKYOTEX SA (CH) 2013-05-16 US claimed
EP-2545918-A1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SA (CH) 2013-01-16 EP 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
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-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 NOX4 2/4885BCHE 1658/4885ACHE 1453/4885
US-20130123256-A1 Pyrazolo Pyridine Derivatives as NADPH Oxidase Inhibitors NOX1, NOX4, CYBB NOX4 2/4885BCHE 1658/4885ACHE 1453/4885

“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.