SCHEMBL7567237

SCHEMBL7567237

CCC(NC(=O)c1cccc2cc3cccc(Br)c3nc12)N(C)C(CC)NC(=O)c1cccc2cc3cccc(Br)c3nc12

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AOX1 Q06278 1/20 0.44
HDAC1 Q13547 2/20 0.36
HDAC6 Q9UBN7 2/20 0.36
RAD52 P43351 3/20 0.35
TAS1R3 Q7RTX0 1/20 0.35
TAS1R1 Q7RTX1 1/20 0.35
TAS1R2 Q8TE23 1/20 0.35
KMT2A Q03164 2/20 0.35
F2R P25116 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 2/20 0.34
TERT O14746 1/20 0.34
SMARCA2 P51531 1/20 0.34
KCNA5 P22460 1/20 0.34
HPGD P15428 1/20 0.34
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.34
HDAC3 O15379 1/20 0.34
HDAC4 P56524 1/20 0.34
HDAC7 Q8WUI4 1/20 0.34

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
SCHEMBL7567999 0.87 AOX1 (0.47) AOX1RAD52KMT2AMEN1ALDH1A1
SCHEMBL7569139 0.87 AOX1 (0.45) AOX1RAD52TAS1R3TAS1R1TAS1R2
SCHEMBL7566415 0.86 RAD52 (0.47) AOX1HDAC1HDAC6RAD52TAS1R3
SCHEMBL8414335 0.86 TAS1R3 (0.46) AOX1RAD52TAS1R3TAS1R1TAS1R2
SCHEMBL8415046 0.84 AOX1 (0.53) AOX1HDAC1HDAC6RAD52KMT2A
SCHEMBL7568211 0.84 AOX1 (0.53) AOX1HDAC1HDAC6RAD52KMT2A
SCHEMBL7564042 0.84 AOX1 (0.46) AOX1HDAC1HDAC6RAD52ALDH1A1
SCHEMBL7567803 0.84 CTSS (0.46) AOX1HDAC1HDAC6RAD52F2R
SCHEMBL7566567 0.84 RAD52 (0.47) AOX1RAD52TAS1R3TAS1R1KMT2A
SCHEMBL8414170 0.83 AOX1 (0.42) AOX1KMT2AMEN1ALDH1A1KCNA5

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 3 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