SCHEMBL7565067

SCHEMBL7565067

Cc1ccc(C(=O)NCCCN(C)CCCNC(=O)c2ccc(C)c3nc4ccccc4nc23)c2nc3ccccc3nc12

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.52
SIGMAR1 Q99720 5/20 0.49
TMEM97 Q5BJF2 3/20 0.49
OPRM1 P35372 1/20 0.49
OPRK1 P41145 1/20 0.49
RAD52 P43351 5/20 0.48
TP53 P04637 2/20 0.47
UHRF1 Q96T88 1/20 0.47
APP P05067 1/20 0.46
MAPT P10636 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
MEN1 O00255 1/20 0.45
ALDH1A1 P00352 1/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
CYP2D6 P10635 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
KMT2A Q03164 1/20 0.45
SMARCA2 P51531 1/20 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
SCHEMBL7568126 0.89 RAD52 (0.56) HTTSIGMAR1TMEM97OPRM1OPRK1
SCHEMBL7567270 0.86 RAD52 (0.61) HTTSIGMAR1TMEM97OPRM1OPRK1
SCHEMBL8415106 0.86 RAD52 (0.55) HTTSIGMAR1TMEM97OPRM1OPRK1
SCHEMBL7565910 0.85 RAD52 (0.55) HTTSIGMAR1TMEM97OPRM1OPRK1
SCHEMBL7566429 0.85 RAD52 (0.60) HTTSIGMAR1TMEM97OPRM1OPRK1
SCHEMBL7564150 0.83 RAD52 (0.51) HTTSIGMAR1TMEM97OPRM1OPRK1
SCHEMBL7566741 0.82 RAD52 (0.58) HTTSIGMAR1TMEM97OPRM1OPRK1
SCHEMBL7566347 0.81 HDAC1 (0.67) HTTSIGMAR1TMEM97OPRM1OPRK1
SCHEMBL8415214 0.80 RAD52 (0.56) HTTSIGMAR1TMEM97OPRM1OPRK1
SCHEMBL7567238 0.79 RAD52 (0.47) HTTSIGMAR1TMEM97OPRM1OPRK1

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