SCHEMBL15907848

SCHEMBL15907848

NOc1c(O)nc(N)[nH]c1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PNP P00491 2/20 0.41
XDH P47989 1/20 0.39
MAPK1 P28482 1/20 0.38
MAPT P10636 3/20 0.37
CDK1 P06493 1/20 0.37
CDK4 P11802 1/20 0.37
CDK2 P24941 1/20 0.37
KMT2A Q03164 3/20 0.37
MEN1 O00255 2/20 0.37
THRB P10828 2/20 0.36
MITF O75030 1/20 0.36
TP53 P04637 1/20 0.36
ALOX15 P16050 1/20 0.36
HBB P68871 1/20 0.36
HIF1A Q16665 1/20 0.36
QTRT1 Q9BXR0 1/20 0.35
TYMS P04818 1/20 0.35
DYRK1A Q13627 1/20 0.34
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33

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
SCHEMBL13833302 0.68 CDK1 (0.66) PNPMAPTCDK1CDK4CDK2
SCHEMBL3180710 0.66 CDK1 (0.52) PNPMAPTCDK1CDK4CDK2
SCHEMBL4570273 0.64 ALDH1A1 (0.54) PNPMAPK1MAPTCDK1CDK4
SCHEMBL9655823 0.63 MAPK1 (0.48) PNPXDHMAPK1MAPTCDK1
SCHEMBL10954474 0.63 MAPK1 (0.41) PNPXDHMAPK1MAPTCDK1
SCHEMBL10169133 0.63 NPSR1 (0.66) PNPMAPK1MAPTKMT2AMEN1
SCHEMBL9653630 0.63 NPSR1 (0.49) PNPXDHMAPK1MAPTCDK1
SCHEMBL42761 0.60 KDM4E (0.53) PNPMAPTCDK1CDK4CDK2
SCHEMBL42760 0.60 PNP (0.73) PNPMAPTKMT2AMEN1THRB
SCHEMBL1271646 0.60 CDK1 (0.56) PNPMAPTCDK1CDK4CDK2

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
US-20140213779-A1 RIBOSWITCHES THE UNIVERSITY OF MANCHESTER (GB) 2014-07-31 US disclosed