SCHEMBL4742497

SCHEMBL4742497

CC(=O)Nc1cc(N(C)C)ccc1/N=N/c1c(C#N)cnn1C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.40
NPSR1 Q6W5P4 1/20 0.37
POLB P06746 1/20 0.36
HTT P42858 3/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2C19 P33261 1/20 0.35
ALDH1A1 P00352 3/20 0.35
LMNA P02545 1/20 0.35
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
KCNH2 Q12809 5/20 0.34
CSNK2A1 P68400 4/20 0.34
CSNK2A2 P19784 3/20 0.34
CSNK2B P67870 3/20 0.34
DYRK3 O43781 1/20 0.34
CDK2 P24941 1/20 0.34
GSK3B P49841 1/20 0.34
PIM3 Q86V86 1/20 0.34
HIPK2 Q9H2X6 1/20 0.34

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
SCHEMBL4742455 0.85 KCNH2 (0.36) MAPTNPSR1MAPK1KCNH2STK4
SCHEMBL22004959 0.77 MAPT (0.39) MAPTNPSR1HTTALDH1A1KCNH2
SCHEMBL21310344 0.77 MAPT (0.39) MAPTNPSR1POLBHTTSMN1; SMN2
SCHEMBL20381283 0.75 ALDH1A1 (0.36) MAPTNPSR1POLBALDH1A1TSHR
SCHEMBL19486415 0.74 MAPT (0.50) MAPTNPSR1HTTSMN1; SMN2ALDH1A1
SCHEMBL20381278 0.74 ALDH1A1 (0.34) MAPTNPSR1POLBALDH1A1TSHR
SCHEMBL22004961 0.73 MAPT (0.49) MAPTNPSR1HTTSMN1; SMN2ALDH1A1
SCHEMBL20169550 0.71 MAPT (0.39) MAPTNPSR1HTTALDH1A1KCNH2
SCHEMBL4742428 0.71 KCNH2 (0.35) MAPTNPSR1SMN1; SMN2ALDH1A1LMNA
SCHEMBL15886715 0.71 MAPT (0.51) MAPTNPSR1POLBHTTSMN1; SMN2

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