SCHEMBL4742592

SCHEMBL4742592

CC(=O)Nc1ccc(-n2c(O)c(N=Nc3c(C#N)cnn3-c3ncccn3)c(=O)n2C)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 2/20 0.35
PTGS2 P35354 2/20 0.35
KDM4E B2RXH2 4/20 0.34
MAPT P10636 3/20 0.34
NPBWR1 P48145 1/20 0.33
MCHR1 Q99705 1/20 0.33
AR P10275 1/20 0.33
KMT2A Q03164 5/20 0.32
MEN1 O00255 4/20 0.32
CYP3A4 P08684 3/20 0.32
CYP2C19 P33261 3/20 0.32
CYP2C9 P11712 2/20 0.32
NPC1 O15118 2/20 0.32
HPGD P15428 2/20 0.32
RAB9A P51151 2/20 0.32
HSD17B10 Q99714 2/20 0.32
DRD2 P14416 1/20 0.32
FPR2 P25090 1/20 0.32
POLB P06746 1/20 0.32
CSNK2A1 P68400 2/20 0.32

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
SCHEMBL4742172 0.80 PTGS1 (0.36) PTGS1PTGS2KDM4EMAPTNPBWR1
SCHEMBL4742576 0.79 SMN1; SMN2 (0.36) PTGS1PTGS2KDM4EMAPTNPC1
SCHEMBL4742643 0.79 SMN1; SMN2 (0.36) PTGS1PTGS2KDM4EMAPTNPC1
SCHEMBL4742164 0.76 PTGS1 (0.38) PTGS1PTGS2KDM4EMAPTKMT2A
SCHEMBL10102026 0.75 MAP2K1 (0.36) KDM4EMAPTKMT2AMEN1CYP3A4
SCHEMBL12945541 0.73 KDR (0.33) PTGS1PTGS2KDM4EMAPTAR
SCHEMBL4742553 0.72 DPP4 (0.37) PTGS1PTGS2MAPTNPC1HPGD
SCHEMBL4742195 0.72 ABCG2 (0.36) PTGS1PTGS2KDM4EMAPTKMT2A
SCHEMBL4742312 0.72 MEN1 (0.37) KDM4EMAPTKMT2AMEN1CYP3A4
SCHEMBL4781297 0.71 PANK3 (0.34) PTGS1PTGS2CYP2C19CYP1A2KDR

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