SCHEMBL7571933

SCHEMBL7571933

CN(CCCNC(=O)c1cccc2cc3cccc(Cl)c3nc12)CCCNC(=O)c1cccc2cc3cccc(Cl)c3nc12

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SIGMAR1 Q99720 10/20 0.55
TMEM97 Q5BJF2 8/20 0.55
AOX1 Q06278 1/20 0.54
HDAC1 Q13547 1/20 0.50
HDAC6 Q9UBN7 1/20 0.50
RAD52 P43351 4/20 0.47
HPGD P15428 1/20 0.46
APP P05067 1/20 0.45
SMARCA2 P51531 1/20 0.43
OPRM1 P35372 1/20 0.42
OPRK1 P41145 1/20 0.42

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
SCHEMBL7564176 0.88 AOX1 (0.56) SIGMAR1TMEM97AOX1HDAC1HDAC6
SCHEMBL7569011 0.87 RAD52 (0.59) SIGMAR1TMEM97AOX1HDAC1HDAC6
SCHEMBL7565915 0.86 RAD52 (0.57) SIGMAR1TMEM97AOX1HDAC1HDAC6
SCHEMBL7567231 0.86 SIGMAR1 (0.55) SIGMAR1TMEM97AOX1HDAC1HDAC6
SCHEMBL7567967 0.86 AOX1 (0.54) SIGMAR1TMEM97AOX1HDAC1HDAC6
SCHEMBL7567367 0.86 AOX1 (0.56) SIGMAR1TMEM97AOX1HDAC1HDAC6
SCHEMBL7567038 0.86 RAD52 (0.57) SIGMAR1TMEM97AOX1RAD52HPGD
SCHEMBL7566347 0.86 HDAC1 (0.67) SIGMAR1TMEM97AOX1HDAC1HDAC6
SCHEMBL7573617 0.86 HDAC1 (0.49) SIGMAR1TMEM97AOX1HDAC1HDAC6
SCHEMBL7568080 0.85 AOX1 (0.62) SIGMAR1TMEM97AOX1HDAC1HDAC6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0934278-B1 BIS(ACRIDINECARBOXAMIDE) AND BIS(PHENAZINECARBOXAMIDE) AS ANTITUMOUR AGENTS XENOVA LTD (GB) 2002-09-04 EP claimed
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
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