SCHEMBL7566429

SCHEMBL7566429

CN(CCCNC(=O)c1cccc2nc3ccccc3nc12)CCCNC(=O)c1cccc2nc3ccccc3nc12

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 3/20 0.60
SMARCA2 P51531 1/20 0.57
CYP1A2 P05177 2/20 0.51
CYP2C9 P11712 2/20 0.51
CYP2C19 P33261 2/20 0.51
MAPT P10636 2/20 0.51
SIGMAR1 Q99720 4/20 0.51
TMEM97 Q5BJF2 2/20 0.51
OPRM1 P35372 1/20 0.51
OPRK1 P41145 1/20 0.51
HTT P42858 1/20 0.51
HDAC1 Q13547 1/20 0.51
HDAC6 Q9UBN7 1/20 0.51
AOX1 Q06278 1/20 0.49
ALDH1A1 P00352 2/20 0.49
TP53 P04637 2/20 0.48
MEN1 O00255 1/20 0.48
CYP3A4 P08684 1/20 0.48
CYP2D6 P10635 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL8415214 0.94 RAD52 (0.56) RAD52SMARCA2CYP1A2CYP2C9CYP2C19
SCHEMBL8415106 0.93 RAD52 (0.55) RAD52SMARCA2CYP1A2CYP2C9CYP2C19
SCHEMBL8413271 0.91 RAD52 (0.57) RAD52SMARCA2CYP1A2CYP2C9CYP2C19
SCHEMBL7567201 0.90 RAD52 (0.57) RAD52SMARCA2CYP1A2CYP2C9CYP2C19
SCHEMBL7565910 0.90 RAD52 (0.55) RAD52SMARCA2CYP1A2CYP2C9CYP2C19
SCHEMBL7566551 0.90 RAD52 (0.53) RAD52SMARCA2CYP1A2CYP2C9CYP2C19
SCHEMBL7568883 0.90 RAD52 (0.53) RAD52SMARCA2CYP1A2CYP2C9CYP2C19
SCHEMBL7567001 0.89 SIGMAR1 (0.56) RAD52SMARCA2MAPTSIGMAR1TMEM97
SCHEMBL7568126 0.89 RAD52 (0.56) RAD52SMARCA2CYP1A2CYP2C9CYP2C19
SCHEMBL7566741 0.89 RAD52 (0.58) RAD52SMARCA2CYP1A2CYP2C9CYP2C19

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