SCHEMBL19956763

SCHEMBL19956763

CCCCn1c(C)c2c(=O)n(-c3ccc(OCc4ccccc4)cc3)[nH]c2cc1=O

nearest known ligand 0.75

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
NOX4 Q9NPH5 14/20 0.75
CYBB P04839 1/20 0.52
NPC1 O15118 3/20 0.45
RAB9A P51151 3/20 0.45
L3MBTL1 Q9Y468 3/20 0.45
KDM4E B2RXH2 1/20 0.45
MEN1 O00255 1/20 0.45
USP2 O75604 1/20 0.45
POLB P06746 1/20 0.45
MAPT P10636 1/20 0.45
THRB P10828 1/20 0.45
APEX1 P27695 1/20 0.45
RECQL P46063 1/20 0.45
KMT2A Q03164 1/20 0.45
MPL P40238 1/20 0.43
PKM P14618 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41

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
SCHEMBL1303426 0.91 NOX4 (0.70) NOX4CYBBNPC1RAB9AL3MBTL1
SCHEMBL1303175 0.86 NOX4 (1.00) NOX4CYBBNPC1RAB9AL3MBTL1
SCHEMBL2219544 0.83 NOX4 (0.72) NOX4CYBBNPC1RAB9AL3MBTL1
SCHEMBL1302232 0.82 NOX4 (0.68) NOX4CYBBMPL
SCHEMBL2219961 0.82 NOX4 (0.60) NOX4CYBBUSP2
SCHEMBL1302246 0.80 NOX4 (0.62) NOX4CYBBMEN1KMT2AMPL
SCHEMBL2220922 0.79 NOX4 (0.56) NOX4CYBB
SCHEMBL2218143 0.78 NOX4 (0.55) NOX4CYBB
SCHEMBL3615946 0.78 NOX4 (1.00) NOX4CYBBNPC1RAB9AL3MBTL1
SCHEMBL3618610 0.78 NOX4 (0.77) NOX4CYBBNPC1RAB9AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2860179-B1 Pyrazolo pyridine derivatives as NADPH oxidase inhibitors GENKYOTEX SUISSE SA (CH) 2018-03-14 EP disclosed