SCHEMBL8525149

SCHEMBL8525149

COc1ccc(-c2n[nH]c(-c3ccccn3)nc2=O)cc1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 4/20 0.54
PDE4B Q07343 4/20 0.54
PDE4C Q08493 4/20 0.54
PDE4D Q08499 4/20 0.54
ADORA1 P30542 1/20 0.47
NOTUM Q6P988 1/20 0.46
L3MBTL1 Q9Y468 5/20 0.46
SMN1; SMN2 Q16637 4/20 0.46
KDM4E B2RXH2 4/20 0.46
TDP1 Q9NUW8 2/20 0.46
LMNA P02545 1/20 0.46
POLB P06746 1/20 0.46
HTT P42858 1/20 0.46
HSD17B10 Q99714 3/20 0.45
NPC1 O15118 3/20 0.44
RAB9A P51151 2/20 0.44
ALOX15 P16050 2/20 0.44
ALPL P05186 1/20 0.44
PKM P14618 1/20 0.44
KMT2A Q03164 2/20 0.43

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
SCHEMBL8525257 0.82 SMN1; SMN2 (0.49) NOTUML3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL8525086 0.80 RAB9A (0.60) NOTUML3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL8524775 0.80 NPC1 (0.63) NOTUML3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL8524927 0.78 NPC1 (0.50) NOTUML3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL8525315 0.78 NPC1 (0.50) ADORA1NOTUML3MBTL1SMN1; SMN2KDM4E
SCHEMBL8525155 0.78 L3MBTL1 (0.56) PDE4APDE4BPDE4CPDE4DL3MBTL1
SCHEMBL11281996 0.77 NPC1 (0.50) NOTUML3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL8525304 0.77 NPC1 (0.50) NOTUML3MBTL1SMN1; SMN2KDM4ETDP1
SCHEMBL29496946 0.75 MEN1 (0.56) PDE4AL3MBTL1SMN1; SMN2KDM4EPOLB
SCHEMBL5797361 0.75 MEN1 (0.56) PDE4AL3MBTL1SMN1; SMN2KDM4EPOLB

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
WO-1999007352-A2 METHOD FOR PROMOTING EXPRESSION OF LDL RECEPTOR GENE SUMITOMO PHARMACEUTICALS COMPANY, LIMITED (JP) 1999-02-18 WO claimed