SCHEMBL7572783

SCHEMBL7572783

CC(C)c1ccc2nc3c(C(=O)O)cccc3cc2c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.45
DHODH Q02127 2/20 0.44
AOX1 Q06278 1/20 0.44
SORT1 Q99523 1/20 0.43
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
NPC1 O15118 2/20 0.39
RAB9A P51151 2/20 0.39
NOTUM Q6P988 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
RXRA P19793 1/20 0.38
RXRB P28702 1/20 0.38
RXRG P48443 1/20 0.38
EIF4A3 P38919 1/20 0.38
ADRA2A P08913 1/20 0.37
ADRA2B P18089 1/20 0.37
ADRA2C P18825 1/20 0.37
IKBKE Q14164 2/20 0.36
TBK1 Q9UHD2 2/20 0.36

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
SCHEMBL27480287 0.88 PARP1 (0.48) ALDH1A1AOX1KDM4EGAA
SCHEMBL7566766 0.81 MEN1 (0.60) ALDH1A1AOX1SORT1MEN1KMT2A
SCHEMBL902623 0.79 ALDH1A1 (0.66) ALDH1A1DHODHMEN1KMT2ANPC1
SCHEMBL7031148 0.79 AOX1 (0.74) ALDH1A1AOX1SMN1; SMN2KDM4EHPGD
SCHEMBL7575249 0.78 ALDH1A1 (0.49) ALDH1A1DHODHAOX1MEN1KMT2A
SCHEMBL7569493 0.78 ALDH1A1 (0.49) ALDH1A1DHODHAOX1SORT1MEN1
SCHEMBL7568063 0.78 ALDH1A1 (0.49) ALDH1A1DHODHAOX1MEN1KMT2A
SCHEMBL7030651 0.78 MEN1 (0.53) ALDH1A1AOX1MEN1KMT2ARAB9A
SCHEMBL7566734 0.78 KDM4E (0.51) ALDH1A1MEN1KMT2ANPC1RAB9A
SCHEMBL7565862 0.78 ALDH1A1 (0.49) ALDH1A1DHODHAOX1MEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1116285-C Bis(acridinecarboxamide) and Bis(phenazinecarboxamide) as antitumour agents XENOVA LTD (GB) 2003-07-30 CN disclosed
EP-0934278-B1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LTD (GB) 2002-09-04 EP disclosed
US-6114332-A BACTERICIDES XENOVA LIMITED (GB) 2000-09-05 US disclosed
CN-1240430-A Bis(acridinecarboxamide) and Bis(phenazinecarboxamide) as antitumour agents XENOVA LTD (GB) 2000-01-05 CN disclosed
EP-0934278-A1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LIMITED (GB) 1999-08-11 EP disclosed
WO-1998017650-A1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LIMITED (GB) 1998-04-30 WO disclosed