SCHEMBL10695851

SCHEMBL10695851

CC(C)COn1cnc2ncccc21

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE5A O76074 1/20 0.36
PDE4A P27815 1/20 0.36
PDE4B Q07343 1/20 0.36
PDE4C Q08493 1/20 0.36
PDE4D Q08499 1/20 0.36
LTA4H P09960 1/20 0.36
NPC1 O15118 2/20 0.36
RAB9A P51151 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HIF1A Q16665 1/20 0.36
BACE1 P56817 1/20 0.33
S1PR1 P21453 1/20 0.32
KMT2A Q03164 1/20 0.31
MKNK1 Q9BUB5 1/20 0.31
MKNK2 Q9HBH9 1/20 0.31
HCRTR2 O43614 3/20 0.31
CCNE1 P24864 1/20 0.30

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
SCHEMBL10696473 0.82 LTA4H (0.39) PDE5ALTA4HNPC1RAB9AL3MBTL1
SCHEMBL10695888 0.79 LTA4H (0.40) PDE5APDE4APDE4BPDE4CPDE4D
SCHEMBL3969727 0.76 BACE1 (0.45) LTA4HNPC1RAB9AL3MBTL1HIF1A
SCHEMBL10697815 0.75 LTA4H (0.36) LTA4HBACE1MKNK1MKNK2
SCHEMBL12413756 0.72 POLB (0.46) PDE4APDE4BPDE4CPDE4DLTA4H
SCHEMBL10130691 0.70 LTA4H (0.49) LTA4HNPC1RAB9AKDM4EMAPT
SCHEMBL1106477 0.69 HIF1A (0.45) PDE4APDE4BPDE4CPDE4DLTA4H
SCHEMBL20664871 0.68 HIF1A (0.44) LTA4HNPC1RAB9AKDM4EL3MBTL1
SCHEMBL23760241 0.67 HIF1A (0.43) PDE4APDE4BPDE4CPDE4DLTA4H
SCHEMBL12132422 0.67 LTA4H (0.46) LTA4HNPC1RAB9AMAPTHTT

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0254588-A1 Imidazo[4,5-b] pyridine compounds, process for preparing same and pharmaceutical compositions containing same TOKYO TANABE COMPANY LIMITED (JP) 1988-01-27 EP claimed