SCHEMBL8413337

SCHEMBL8413337

CCC(NC(=O)c1cccc2cc3c(Cl)cccc3nc12)N(C)C(CC)NC(=O)c1cccc2cc3c(Cl)cccc3nc12

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 4/20 0.49
AOX1 Q06278 1/20 0.43
TAS1R3 Q7RTX0 1/20 0.43
TAS1R1 Q7RTX1 1/20 0.43
TAS1R2 Q8TE23 1/20 0.43
TP53 P04637 1/20 0.39
RXFP1 Q9HBX9 1/20 0.39
UHRF1 Q96T88 1/20 0.39
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
TACR3 P29371 3/20 0.38
TACR2 P21452 2/20 0.38
PYGL P06737 1/20 0.37
PDE3B Q13370 1/20 0.37
PDE3A Q14432 1/20 0.37
KDR P35968 1/20 0.36
SMARCA2 P51531 1/20 0.36

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
SCHEMBL8414335 0.86 TAS1R3 (0.46) RAD52AOX1TAS1R3TAS1R1TAS1R2
SCHEMBL8415046 0.85 AOX1 (0.53) RAD52AOX1UHRF1MEN1KMT2A
SCHEMBL7569008 0.84 TAS1R3 (0.44) RAD52AOX1TAS1R3TAS1R1TAS1R2
SCHEMBL8414087 0.83 AOX1 (0.46) RAD52AOX1TAS1R3TAS1R1TAS1R2
SCHEMBL8411181 0.82 RAD52 (0.47) RAD52AOX1TAS1R3TAS1R1TAS1R2
SCHEMBL8415065 0.79 AOX1 (0.47) RAD52AOX1UHRF1MEN1KMT2A
SCHEMBL8411691 0.79 MAPT (0.52) RAD52AOX1TAS1R3TAS1R1TAS1R2
SCHEMBL7567999 0.78 AOX1 (0.47) RAD52AOX1MEN1KMT2APDE3B
SCHEMBL7569139 0.78 AOX1 (0.45) RAD52AOX1TAS1R3TAS1R1TAS1R2
SCHEMBL8411863 0.78 RAD52 (0.43) RAD52AOX1TAS1R3TAS1R1TAS1R2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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