Anthraquinone

Anthraquinone

SCHEMBL4660434

O=C1c2ccccc2C(=O)c2ccccc21.c1ccc2nc3c(nc2c1)[nH]c1ccccc13

nearest known ligand 0.78

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.78
NPC1 O15118 4/20 0.78
SMN1; SMN2 Q16637 4/20 0.78
CASP7 P55210 3/20 0.78
TP53 P04637 2/20 0.78
CASP1 P29466 2/20 0.78
MAPK10 P53779 2/20 0.78
POLB P06746 2/20 0.78
MAPT P10636 8/20 0.58
CYP1A2 P05177 3/20 0.58
CYP2C19 P33261 3/20 0.58
CYP3A4 P08684 2/20 0.58
CYP2C9 P11712 2/20 0.58
MAPK1 P28482 1/20 0.58
PLK4 O00444 1/20 0.50
CHEK1 O14757 1/20 0.50
AURKA O14965 1/20 0.50
DAPK3 O43293 1/20 0.50
CHEK2 O96017 1/20 0.50
CDK1 P06493 1/20 0.50

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
SCHEMBL29572859 0.88 RAB9A (1.00) RAB9ANPC1SMN1; SMN2CASP7TP53
SCHEMBL278729 0.88 RAB9A (1.00) RAB9ANPC1SMN1; SMN2CASP7TP53
SCHEMBL30646327 0.75 SMN1; SMN2 (0.73) RAB9ANPC1SMN1; SMN2CASP7TP53
SCHEMBL30704451 0.75 SMN1; SMN2 (0.73) RAB9ANPC1SMN1; SMN2CASP7TP53
SCHEMBL824397 0.75 SMN1; SMN2 (0.73) RAB9ANPC1SMN1; SMN2CASP7TP53
SCHEMBL824357 0.75 SMN1; SMN2 (0.73) RAB9ANPC1SMN1; SMN2CASP7TP53
SCHEMBL278691 0.74 NPC1 (0.72) RAB9ANPC1SMN1; SMN2CASP7TP53
SCHEMBL9436882 0.74 NPC1 (0.72) RAB9ANPC1SMN1; SMN2CASP7TP53
SCHEMBL8832011 0.74 NPC1 (0.71) RAB9ANPC1SMN1; SMN2CASP7TP53
SCHEMBL8832035 0.74 NPC1 (0.71) RAB9ANPC1SMN1; SMN2CASP7TP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2004847-A2 OLIGONUCLEOTIDES COMPRISING SIGNALLING PAIRS AND HYDROPHOBIC NUCLEOTIDES, STEMLESS BEACONS, FOR DETECTION OF NUCLEIC ACIDS, METHYLATION STATUS AND MUTANTS OF NUCLEIC ACIDS Pentabase Aps (DK) 2008-12-24 EP claimed
WO-2007104318-A2 OLIGONUCLEOTIDES COMPRISING SIGNALLING PAIRS AND HYDROPHOBIC NUCLEOTIDES, STEMLESS BEACONS, FOR DETECTION OF NUCLEIC ACIDS, METHYLATION STATUS AND MUTANTS OF NUCLEIC ACIDS PENTABASE APS (DK) 2007-09-20 WO claimed
EP-1468007-A2 PSEUDONUCLEOTIDE COMPRISING AN INTERCALATOR Human Genetic Signatures PTY Ltd. (AU) 2004-10-20 EP disclosed
WO-2003052134-A2 OLIGONUCLEOTIDES COMPRISING INTERCALATOR PSEUDONUCLEOTIDE(S) FOR DETECTION OF NUCLEIC ACIDS AND MUTANTS HEREOF HUMAN GENETIC SIGNATURES PTY LTD (AU) 2003-06-26 WO disclosed
WO-2003052133-A2 OLIGONUCLEOTIDE ANALOGUES COMPRISING INTERCALATOR PSEUDONUCLEOTIDES HUMAN GENETIC SIGNATURES PTY LTD (AU) 2003-06-26 WO disclosed
WO-2003052132-A2 LINEAR AND HAIRPIN OLIGONUCLEOTIDE ANALOGUES COMPRISING INTERCALATOR PSEUDONUCLEOTIDES HUMAN GENETIC SIGNATURES PTY LTD (AU) 2003-06-26 WO disclosed
WO-2003051901-A2 PSEUDONUCLEOTIDE COMPRISING AN INTERCALATOR HUMAN GENETIC SIGNATURES PTY LTD (AU) 2003-06-26 WO disclosed