SCHEMBL7567101

SCHEMBL7567101

CCC(NC(=O)c1cccc2nc3cccc(F)c3nc12)C(N)C(CC)NC(=O)c1cccc2nc3cccc(F)c3nc12

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAD52 P43351 3/20 0.55
MAPT P10636 4/20 0.39
CYP2C9 P11712 3/20 0.39
CYP1A2 P05177 2/20 0.39
CYP2C19 P33261 2/20 0.39
HTT P42858 3/20 0.38
THRB P10828 1/20 0.38
KDM4E B2RXH2 3/20 0.37
TAS1R3 Q7RTX0 1/20 0.37
TAS1R1 Q7RTX1 1/20 0.37
TAS1R2 Q8TE23 1/20 0.37
KMT2A Q03164 3/20 0.37
GAA P10253 1/20 0.37
ATM Q13315 1/20 0.37
ALDH1A1 P00352 1/20 0.36
SMARCA2 P51531 1/20 0.36
TACR3 P29371 1/20 0.36
MEN1 O00255 2/20 0.35
CYP3A4 P08684 1/20 0.35
CYP2D6 P10635 1/20 0.35

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
SCHEMBL7566425 0.88 MAPT (0.51) RAD52MAPTCYP2C9CYP1A2CYP2C19
SCHEMBL7566738 0.87 MAPT (0.48) RAD52MAPTCYP2C9CYP1A2CYP2C19
SCHEMBL7567031 0.86 TAS1R3 (0.48) RAD52MAPTCYP2C9CYP1A2CYP2C19
SCHEMBL7565911 0.86 RAD52 (0.39) RAD52KDM4ETAS1R3TAS1R1TAS1R2
SCHEMBL7573559 0.84 RAD52 (0.48) RAD52MAPTCYP2C9CYP1A2CYP2C19
SCHEMBL7565908 0.83 MAPT (0.49) RAD52MAPTCYP2C9CYP1A2CYP2C19
SCHEMBL8411626 0.82 RAD52 (0.65) RAD52MAPTCYP2C9CYP1A2CYP2C19
SCHEMBL7566996 0.82 TAS1R3 (0.49) RAD52MAPTCYP2C9CYP1A2CYP2C19
SCHEMBL7566548 0.81 MAPT (0.45) RAD52MAPTCYP2C9CYP1A2CYP2C19
SCHEMBL7568879 0.81 MAPT (0.45) RAD52MAPTCYP2C9CYP1A2CYP2C19

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