SCHEMBL8920440

SCHEMBL8920440

O=C1c2ccccc2C(=O)c2[nH]c(=O)ccc21

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.56
POLB P06746 4/20 0.56
APAF1 O14727 3/20 0.56
PAX8 Q06710 1/20 0.56
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
CDC25B P30305 3/20 0.52
TDP2 O95551 4/20 0.48
NSD2 O96028 1/20 0.48
IDO1 P14902 2/20 0.46
CTH P32929 1/20 0.46
SMN1; SMN2 Q16637 5/20 0.44
NPC1 O15118 4/20 0.44
MAPK1 P28482 4/20 0.44
MAPT P10636 4/20 0.44
KDM4E B2RXH2 3/20 0.44
LMNA P02545 3/20 0.44
MAOA P21397 3/20 0.44
BLM P54132 2/20 0.44
PLA2G1B P04054 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
SCHEMBL6269145 0.86 TDP2 (0.55) RAB9APOLBAPAF1PAX8MEN1
SCHEMBL8919698 0.77 GAA (0.60) PAX8MEN1KMT2ACDC25BTDP2
SCHEMBL16432617 0.73 MEN1 (0.57) RAB9APOLBAPAF1PAX8MEN1
Anthraquinone SCHEMBL1901249 0.72 MEN1 (1.00) RAB9APOLBAPAF1PAX8MEN1
Anthraquinone SCHEMBL14943 0.72 MEN1 (1.00) RAB9APOLBAPAF1PAX8MEN1
Anthraquinone SCHEMBL29358690 0.72 MEN1 (1.00) RAB9APOLBAPAF1PAX8MEN1
SCHEMBL10752577 0.71 CES1 (0.59) RAB9APOLBAPAF1PAX8KMT2A
SCHEMBL2922398 0.70 PDE10A (0.52) SMN1; SMN2MAPK1KDM4EHTTALDH1A1
Anthraquinone SCHEMBL8081485 0.69 MEN1 (0.92) RAB9APOLBAPAF1PAX8MEN1
Anthraquinone SCHEMBL6415478 0.69 MEN1 (0.92) RAB9APOLBAPAF1PAX8MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5605905-A DIAZAQUINOMICIN ANALOGS UNIVERSIDAD COMPLUTENSE DE MADRID (ES) 1997-02-25 US disclosed
EP-0574195-A1 Antitumoral aza- and diazaanthracenes UNIVERSIDAD COMPLUTENSE DE MADRID (ES) 1993-12-15 EP disclosed