SCHEMBL7564928

SCHEMBL7564928

Cc1cccc2nc3cccc(C(=O)NCCCC(N)(CN)CCCNC(=O)c4cccc5nc6cccc(C)c6nc45)c3nc12

nearest known ligand 0.47

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 3/20 0.47
CYP1A2 P05177 1/20 0.45
MAPT P10636 1/20 0.45
CYP2C9 P11712 1/20 0.45
CYP2C19 P33261 1/20 0.45
SMARCA2 P51531 1/20 0.43
HPGD P15428 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC6 Q9UBN7 1/20 0.39
KMT2A Q03164 2/20 0.38
MEN1 O00255 1/20 0.38
HTT P42858 2/20 0.36
TSHR P16473 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
SCHEMBL3811646 0.93 RAD52 (0.48) RAD52CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL7571817 0.87 RAD52 (0.51) RAD52CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL7566555 0.87 RAD52 (0.47) RAD52CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL8415115 0.83 RAD52 (0.52) RAD52CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL14440022 0.82 RAD52 (0.51) RAD52CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL7564926 0.82 RAD52 (0.50) RAD52CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL7566368 0.81 RAD52 (0.42) RAD52CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL7564929 0.80 RAD52 (0.54) RAD52CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL8415109 0.80 RAD52 (0.47) RAD52CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL626969 0.80 RAD52 (0.55) RAD52CYP1A2MAPTCYP2C9CYP2C19

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