SCHEMBL29778657

SCHEMBL29778657

Oc1ccccc1-c1nc2c(O)cccc2s1.[Zn]

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDPK1 O15530 1/20 0.54
APP P05067 2/20 0.54
RAB9A P51151 7/20 0.47
MAPT P10636 5/20 0.47
NPC1 O15118 4/20 0.47
KDM4E B2RXH2 4/20 0.47
NPSR1 Q6W5P4 2/20 0.47
ILK Q13418 1/20 0.47
RET P07949 1/20 0.46
FLT1 P17948 1/20 0.46
KDR P35968 1/20 0.46
MAPK14 Q16539 1/20 0.46
HTR2B P41595 3/20 0.45
DYRK1A Q13627 1/20 0.45
KMT2A Q03164 5/20 0.44
SMN1; SMN2 Q16637 4/20 0.44
MEN1 O00255 4/20 0.44
GAA P10253 3/20 0.44
TDP1 Q9NUW8 2/20 0.44
L3MBTL1 Q9Y468 2/20 0.44

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
SCHEMBL27670304 0.98 PDPK1 (0.56) PDPK1APPRAB9AMAPTNPC1
SCHEMBL11698798 0.85 SMN1; SMN2 (0.59) PDPK1APPRAB9AMAPTNPC1
SCHEMBL21089196 0.85 RET (0.49) PDPK1APPRAB9AMAPTNPC1
SCHEMBL20477485 0.85 MAPT (0.44) PDPK1APPRAB9AMAPTNPC1
SCHEMBL28371764 0.85 RAB9A (0.44) PDPK1APPRAB9AMAPTNPC1
SCHEMBL27509531 0.85 RAB9A (0.44) PDPK1APPRAB9AMAPTNPC1
SCHEMBL21089384 0.83 NPC1 (0.42) PDPK1APPRAB9AMAPTNPC1
SCHEMBL3261894 0.81 KDM4E (0.71) APPRAB9AMAPTNPC1KDM4E
SCHEMBL359505 0.81 KDM4E (0.71) APPRAB9AMAPTNPC1KDM4E
SCHEMBL483414 0.81 APP (0.68) PDPK1APPRAB9AMAPTNPC1

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
CN-110511593-B Azo pigment, color filter, colorant and coloring composition for the same, and display device and image pickup element comprising the same 东洋油墨SC控股株式会社 2022-07-08 CN disclosed