SCHEMBL4764415

SCHEMBL4764415

COc1cc(NC(=O)C(N=Nc2c(C#N)cnn2-c2ccccn2)C(C)=O)c(OC)cc1Cl

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.43
HPGD P15428 1/20 0.43
MAPK1 P28482 1/20 0.43
GAA P10253 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
HTT P42858 1/20 0.38
CHEK1 O14757 3/20 0.38
MALT1 Q9UDY8 1/20 0.37
KDM4E B2RXH2 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.37
POLB P06746 1/20 0.36
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDR P35968 1/20 0.36
SRC P12931 2/20 0.36
MAPT P10636 1/20 0.35

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
SCHEMBL4742993 0.92 GAA (0.36) ALDH1A1HPGDMAPK1GAASMN1; SMN2
SCHEMBL4742858 0.89 ALDH1A1 (0.42) ALDH1A1SMN1; SMN2HTTKDM4EIRAK4
SCHEMBL4742958 0.82 KDM4E (0.43) ALDH1A1SMN1; SMN2HTTKDM4EIRAK4
SCHEMBL4771687 0.82 PDE9A (0.37) ALDH1A1SMN1; SMN2HTTKDM4EPOLB
SCHEMBL4742957 0.81 GFER (0.40) ALDH1A1SMN1; SMN2HTTKDM4EIRAK4
SCHEMBL4743018 0.80 IRAK4 (0.42) ALDH1A1SMN1; SMN2CHEK1KDM4EIRAK4
SCHEMBL4742942 0.80 HTT (0.36) ALDH1A1HPGDGAASMN1; SMN2HTT
SCHEMBL4781307 0.79 GRM4 (0.32) ALDH1A1HPGDGAACHEK1KDM4E
SCHEMBL4743340 0.78 MAPT (0.44) ALDH1A1MAPK1SMN1; SMN2HTTPOLB
SCHEMBL4771692 0.78 SMN1; SMN2 (0.38) ALDH1A1GAASMN1; SMN2HTTPOLB

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