SCHEMBL7570902

SCHEMBL7570902

Cc1cccc2nc3cccc(C(=O)NC(C)CC(N)(CCCN)CC(C)NC(=O)c4cccc5nc6cccc(C)c6nc45)c3nc12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2C9 P11712 1/20 0.42
CYP2C19 P33261 1/20 0.42
RAD52 P43351 2/20 0.37
KDM4E B2RXH2 3/20 0.35
HTT P42858 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
LMNA P02545 2/20 0.33
HPGD P15428 2/20 0.33
KMT2A Q03164 2/20 0.33
GAA P10253 2/20 0.33
ATM Q13315 1/20 0.33
SMARCA2 P51531 1/20 0.32
HSD17B10 Q99714 2/20 0.32
MEN1 O00255 1/20 0.32
PYGL P06737 1/20 0.32
THRB P10828 2/20 0.32
ALDH1A1 P00352 2/20 0.32
APAF1 O14727 1/20 0.32

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
SCHEMBL7571813 0.82 MAPT (0.46) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL7572020 0.81 MAPT (0.42) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL21798649 0.79 MAPT (0.51) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL7564928 0.77 RAD52 (0.47) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL7571817 0.77 RAD52 (0.51) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL21798672 0.76 MAPT (0.47) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL21798673 0.75 MAPT (0.46) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL3811646 0.75 RAD52 (0.48) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL21798679 0.73 MAPT (0.45) MAPTCYP1A2CYP2C9CYP2C19RAD52
SCHEMBL14440022 0.72 RAD52 (0.51) MAPTCYP1A2CYP2C9CYP2C19RAD52

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