SCHEMBL273523

SCHEMBL273523

C/C=N/NC(=O)c1ccccc1NC(=O)c1ccc(OC)c(OC)c1

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PKM P14618 3/20 0.72
NPC1 O15118 3/20 0.72
RAB9A P51151 2/20 0.72
KDM4E B2RXH2 5/20 0.71
HTT P42858 2/20 0.71
OPRK1 P41145 1/20 0.71
TDP1 Q9NUW8 1/20 0.71
CHEK1 O14757 1/20 0.68
PIM1 P11309 1/20 0.68
MAPK8 P45983 1/20 0.68
CLK4 Q9HAZ1 1/20 0.68
ALDH1A1 P00352 3/20 0.67
PDE4D Q08499 1/20 0.59
MAPT P10636 2/20 0.59
HPGD P15428 2/20 0.59
NPSR1 Q6W5P4 3/20 0.57
TSHR P16473 1/20 0.57
HSD17B10 Q99714 1/20 0.57
KMT2A Q03164 4/20 0.57
MEN1 O00255 3/20 0.57

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
SCHEMBL268073 0.88 NPC1 (0.85) PKMNPC1RAB9AKDM4EHTT
SCHEMBL268074 0.88 NPC1 (0.85) PKMNPC1RAB9AKDM4EHTT
SCHEMBL266882 0.87 MAPT (0.79) PKMNPC1RAB9AKDM4EHTT
SCHEMBL266884 0.87 MAPT (0.79) PKMNPC1RAB9AKDM4EHTT
SCHEMBL267011 0.86 PKM (0.81) PKMNPC1RAB9AKDM4EHTT
SCHEMBL267010 0.86 PKM (0.81) PKMNPC1RAB9AKDM4EHTT
SCHEMBL268654 0.85 PKM (0.71) PKMNPC1RAB9AKDM4EHTT
SCHEMBL268931 0.85 NPC1 (0.77) PKMNPC1RAB9AKDM4EHTT
SCHEMBL268930 0.85 NPC1 (0.77) PKMNPC1RAB9AKDM4EHTT
SCHEMBL266394 0.85 PKM (0.77) PKMNPC1RAB9AKDM4EHTT

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
US-8134015-B2 Compound inhibiting in vivo phosphorous transport and medicine containing the same KYOWA HAKKO KIRIN CO., LTD. (JP) 2012-03-13 US disclosed