SCHEMBL4779664

SCHEMBL4779664

N#Cc1cnn(-c2ncccn2)c1N=NC(C(=O)Nc1ccccc1C(=O)O)c1nc2ccccc2c(=O)[nH]1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.34
PARP2 Q9UGN5 1/20 0.34
MALT1 Q9UDY8 4/20 0.33
PDE5A O76074 1/20 0.33
KMT2A Q03164 2/20 0.32
MEN1 O00255 1/20 0.32
POLB P06746 1/20 0.32
PKM P14618 1/20 0.32
HCAR2 Q8TDS4 3/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 2/20 0.32
LMNA P02545 2/20 0.32
HPGD P15428 1/20 0.32
TSHR P16473 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
G6PD P11413 1/20 0.32
CYP2C8 P10632 1/20 0.32
CYP2C9 P11712 1/20 0.32
RAB9A P51151 1/20 0.31

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
SCHEMBL4742752 0.94 MALT1 (0.33) PARP1PARP2MALT1KMT2AMEN1
SCHEMBL4742750 0.93 KDM4E (0.41) PARP1PARP2MALT1PDE5AKMT2A
SCHEMBL10280956 0.92 PARP1 (0.34) PARP1PARP2MALT1PDE5AKMT2A
SCHEMBL4742753 0.91 PARP1 (0.35) PARP1PARP2KMT2AMEN1POLB
SCHEMBL4742764 0.91 KMT2A (0.38) PARP1PARP2MALT1PDE5AKMT2A
SCHEMBL4779837 0.91 PARP1 (0.36) PARP1PARP2MALT1KMT2APOLB
SCHEMBL4742774 0.91 LMNA (0.35) PARP1PARP2MALT1KMT2AMEN1
SCHEMBL4742760 0.90 G6PD (0.39) PARP1PARP2MALT1KMT2APOLB
SCHEMBL4742716 0.89 PDE9A (0.41) PARP1PARP2ALDH1A1LMNATSHR
SCHEMBL4780180 0.87 PARP1 (0.32) PARP1PARP2MALT1POLBPKM

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8177861-B2 AZO pigment, pigment dispersion containing the AZO pigment, and coloring composition FUJIFILM CORPORATION (JP) 2012-05-15 US disclosed
US-20110021764-A1 AZO PIGMENT, PIGMENT DISPERSION CONTAINING THE AZO PIGMENT, AND COLORING COMPOSITION FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed