SCHEMBL4742432

SCHEMBL4742432

CCN(CC)c1cc(NC(C)=O)c(/N=N/c2c(C#N)cnn2-c2ncccn2)cc1OC

nearest known ligand 0.34

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HPGD P15428 1/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
STK4 Q13043 9/20 0.33
ATM Q13315 1/20 0.33
CSNK2A1 P68400 1/20 0.33
ALDH1A1 P00352 2/20 0.32
EGFR P00533 1/20 0.32
ERBB2 P04626 1/20 0.32
APOBEC3G Q9HC16 1/20 0.32
STK3 Q13188 1/20 0.31
MAPT P10636 1/20 0.31
CRHR1 P34998 1/20 0.31
PTGS1 P23219 1/20 0.31
PTGS2 P35354 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
SCHEMBL4743225 1.00 HPGD (0.34) HPGDSMN1; SMN2STK4ATMCSNK2A1
SCHEMBL4742455 0.77 KCNH2 (0.36) STK4ATMMAPTPTGS1PTGS2
SCHEMBL9013008 0.74 MAPK8 (0.32) HPGDSMN1; SMN2
SCHEMBL9013003 0.74 MAPK8 (0.32) HPGDSMN1; SMN2
SCHEMBL887561 0.73 ALDH1A1 (0.39) HPGDSMN1; SMN2ATMALDH1A1MAPT
SCHEMBL4742480 0.73 ALDH1A1 (0.39) HPGDSTK4ATMALDH1A1STK3
SCHEMBL4742439 0.73 ALDH1A1 (0.38) HPGDSMN1; SMN2ALDH1A1MAPTPTGS1
SCHEMBL4742442 0.73 MAPT (0.35) HPGDSMN1; SMN2CSNK2A1ALDH1A1MAPT
SCHEMBL9012968 0.72 MAPK8 (0.31)
SCHEMBL9012964 0.72 MAPK8 (0.31)

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 4 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-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
US-20110021764-A1 AZO PIGMENT, PIGMENT DISPERSION CONTAINING THE AZO PIGMENT, AND COLORING COMPOSITION FUJIFILM CORPORATION (JP) 2011-01-27 US disclosed