SCHEMBL6745385

SCHEMBL6745385

Cn1c(=O)n(C)c2cc(O)c(N)cc21

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.64
S100B P04271 1/20 0.58
SMN1; SMN2 Q16637 8/20 0.47
ALDH1A1 P00352 7/20 0.47
HSD17B10 Q99714 4/20 0.47
KDM4E B2RXH2 3/20 0.47
BRD4 O60885 2/20 0.47
BRPF1 P55201 2/20 0.47
TP53 P04637 1/20 0.41
GLA P06280 1/20 0.40
PKM P14618 2/20 0.39
POLB P06746 1/20 0.39
PIK3CG P48736 2/20 0.39
MAPT P10636 2/20 0.38
CASP1 P29466 1/20 0.38
RAB9A P51151 1/20 0.38
PIK3CD O00329 1/20 0.38
PIK3CA P42336 1/20 0.38
PIK3CB P42338 1/20 0.38
HTT P42858 2/20 0.37

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
SCHEMBL16771511 0.78 ATAD2 (1.00) ATAD2S100BSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL30349855 0.77 ATAD2 (0.62) ATAD2S100BSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL14995348 0.77 ATAD2 (0.62) ATAD2S100BSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL17534190 0.77 ATAD2 (0.68) ATAD2S100BSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL2782379 0.76 ATAD2 (0.56) ATAD2S100BSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL3878171 0.76 PABPC1 (0.40) ATAD2S100BSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL3873513 0.76 PABPC1 (0.43) ATAD2S100BSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL30326002 0.72 S100B (0.56) ATAD2S100BSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL2924795 0.72 S100B (0.56) ATAD2S100BSMN1; SMN2ALDH1A1HSD17B10
SCHEMBL17534246 0.72 S100B (0.54) ATAD2S100BBRPF1MAPTHTT

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-20040107518-A1 Hetero-anellated ortho-aminophenols and their use as dye components CLARIANT FINANCE (BVI) LIMITED (BR) 2004-06-10 US disclosed