SCHEMBL7568792

SCHEMBL7568792

O=C(O)c1cccc2cc3cccc(Br)c3nc12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.46
NR4A1 P22736 1/20 0.43
NR4A2 P43354 1/20 0.43
NR4A3 Q92570 1/20 0.43
PRNP P04156 1/20 0.42
HSD17B10 Q99714 1/20 0.42
PTPN1 P18031 1/20 0.41
BACE1 P56817 1/20 0.41
LMNA P02545 1/20 0.40
ALOX12 P18054 1/20 0.40
ALOX15 P16050 1/20 0.39
KDM4E B2RXH2 3/20 0.39
HPGD P15428 2/20 0.39
FABP4 P15090 1/20 0.39
CDC25B P30305 1/20 0.39
KEAP1 Q14145 1/20 0.39
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
PSMD14 O00487 1/20 0.38
NPC1 O15118 1/20 0.38

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
SCHEMBL27448687 0.85 PARP1 (0.53) ALDH1A1BACE1KDM4EPARP1
SCHEMBL7983249 0.81 BACE1 (0.56) ALDH1A1BACE1LMNAKDM4EHPGD
SCHEMBL17801432 0.80 ALDH1A1 (0.47) ALDH1A1HSD17B10BACE1LMNAKDM4E
SCHEMBL7567221 0.79 TSHR (0.52) ALDH1A1NR4A1NR4A2NR4A3HSD17B10
SCHEMBL5459806 0.79 ALDH1A1 (0.50) ALDH1A1NR4A1NR4A2NR4A3HSD17B10
SCHEMBL7571768 0.79 ALB (0.50) ALDH1A1NR4A1NR4A2NR4A3HSD17B10
SCHEMBL7569493 0.78 ALDH1A1 (0.49) ALDH1A1NR4A1PRNPHSD17B10ALOX15
SCHEMBL7570690 0.78 ALDH1A1 (0.49) ALDH1A1NR4A1NR4A2NR4A3PRNP
SCHEMBL902623 0.77 ALDH1A1 (0.66) ALDH1A1NR4A1NR4A2NR4A3HSD17B10
SCHEMBL7571806 0.77 HNF4A (0.53) ALDH1A1NR4A1NR4A2NR4A3HSD17B10

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