SCHEMBL4742659

SCHEMBL4742659

COc1ccccc1NC(=O)C(N=Nc1c(C#N)cnn1-c1ncccn1)c1ccccn1

nearest known ligand 0.43

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.38
ALDH1A1 P00352 3/20 0.38
SMN1; SMN2 Q16637 3/20 0.38
NPC1 O15118 1/20 0.38
RAB9A P51151 1/20 0.38
IRAK4 Q9NWZ3 1/20 0.38
GFER P55789 1/20 0.37
USP2 O75604 1/20 0.36
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.36
PDE9A O76083 1/20 0.35
AHR P35869 1/20 0.35
POLB P06746 1/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
CYP1A2 P05177 1/20 0.35
CYP2D6 P10635 1/20 0.35
CYP2C19 P33261 1/20 0.35
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
SCHEMBL4780174 0.89 GFER (0.41) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4742957 0.86 GFER (0.40) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4780194 0.86 GFER (0.40) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4742662 0.84 PDE9A (0.38) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4742664 0.84 PKM (0.39) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4742670 0.84 LMNA (0.38) KDM4ESMN1; SMN2NPC1RAB9AIRAK4
SCHEMBL4742667 0.84 MPO (0.38) KDM4ESMN1; SMN2NPC1RAB9AIRAK4
SCHEMBL4743026 0.84 GFER (0.38) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4742968 0.83 GFER (0.37) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4742727 0.83 MEN1 (0.33) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A

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