SCHEMBL4742664

SCHEMBL4742664

COc1ccccc1NC(=O)C(N=Nc1c(C#N)cnn1-c1ncccn1)c1nc2ccccc2s1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 2/20 0.39
HTT P42858 1/20 0.39
MAPT P10636 3/20 0.38
KDM4E B2RXH2 3/20 0.38
ATM Q13315 1/20 0.38
NPC1 O15118 6/20 0.37
RAB9A P51151 6/20 0.37
ADORA3 P0DMS8 1/20 0.37
MEN1 O00255 5/20 0.36
KMT2A Q03164 5/20 0.36
TP53 P04637 2/20 0.35
PAX8 Q06710 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MAPK9 P45984 1/20 0.34
MAPK10 P53779 1/20 0.34
IRAK4 Q9NWZ3 1/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
ALDH1A1 P00352 1/20 0.34
LMNA P02545 1/20 0.34
THRB P10828 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
SCHEMBL4742659 0.84 KDM4E (0.38) MAPTKDM4ENPC1RAB9AMEN1
SCHEMBL4742670 0.84 LMNA (0.38) PKMMAPTKDM4ENPC1RAB9A
SCHEMBL4742667 0.84 MPO (0.38) PKMHTTMAPTKDM4ENPC1
SCHEMBL4780174 0.83 GFER (0.41) PKMHTTMAPTKDM4ENPC1
SCHEMBL4742675 0.82 PDE9A (0.38) PKMMAPTKDM4ENPC1RAB9A
SCHEMBL4742716 0.82 PDE9A (0.41) MAPTADORA3TP53SMN1; SMN2ALDH1A1
SCHEMBL4742957 0.81 GFER (0.40) HTTMAPTKDM4ENPC1RAB9A
SCHEMBL4780194 0.81 GFER (0.40) PKMHTTMAPTKDM4ENPC1
SCHEMBL4742662 0.81 PDE9A (0.38) PKMMAPTKDM4ENPC1RAB9A
SCHEMBL4743003 0.80 RAB9A (0.48) PKMHTTMAPTKDM4EATM

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