SCHEMBL4249530

SCHEMBL4249530

CSc1nc(N)cc(NC(C)=O)n1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ADORA3 P0DMS8 10/20 0.56
ADORA2A P29274 4/20 0.56
MEN1 O00255 1/20 0.54
KMT2A Q03164 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.42
ADORA1 P30542 3/20 0.41
CYP1A2 P05177 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
MAPK8 P45983 6/20 0.40
MAPK9 P45984 5/20 0.40
ADORA2B P29275 1/20 0.39
PRKD3 O94806 2/20 0.38
MAP4K4 O95819 2/20 0.38
MAPK10 P53779 2/20 0.38
MAP4K2 Q12851 2/20 0.38
PKN2 Q16513 1/20 0.38
PRKD2 Q9BZL6 1/20 0.38
STK17A Q9UEE5 1/20 0.38
CHUK O15111 1/20 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
SCHEMBL16302718 0.81 ADORA3 (0.57) ADORA3ADORA2AMEN1KMT2AL3MBTL1
SCHEMBL21338154 0.81 ADORA3 (0.57) ADORA3ADORA2AMEN1KMT2AL3MBTL1
SCHEMBL3280779 0.80 ADORA3 (0.56) ADORA3ADORA2AMEN1KMT2AL3MBTL1
SCHEMBL15942899 0.79 GAA (0.49) ADORA3ADORA2AMEN1KMT2AL3MBTL1
SCHEMBL9413801 0.77 MEN1 (0.41) MEN1KMT2AL3MBTL1CYP1A2CYP2C9
SCHEMBL8681523 0.76 TP53 (0.47) ADORA3ADORA2AMEN1KMT2ACYP1A2
SCHEMBL6307189 0.76 NPC1 (0.47) MEN1KMT2A
SCHEMBL11305748 0.76 ADORA3 (0.38) ADORA3ADORA2AMEN1KMT2AL3MBTL1
SCHEMBL3625881 0.73 HSP90AB1 (0.46) MEN1KMT2A
SCHEMBL899319 0.73 MEN1 (0.47) ADORA3ADORA2AMEN1KMT2AL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100068472-A1 Yellow Azo Dyes for Ink Jet Printing FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-03-18 US disclosed
US-20100068472-A1 Yellow Azo Dyes for Ink Jet Printing FUJIFILM IMAGING COLORANTS LIMITED (GB) 2010-03-18 US disclosed
US-20090017278-A1 Ink-Jet Printing Using Disazo Dyes FUJIFILM IMAGING COLORANTS LIMITED (GB) 2009-01-15 US disclosed
WO-2007091006-A2 INK-JET PRINTING USING DISAZO DYES FUJIFILM IMAGING COLORANTS LIMITED (GB) 2007-08-16 WO disclosed
WO-2007045830-A2 YELLOW AZO DYES FOR INK JET PRINTING FUJIFILM IMAGING COLORANTS LIMITED (GB) 2007-04-26 WO disclosed