SCHEMBL7566595

SCHEMBL7566595

Cc1ccc(C)c2nc3c(C(=O)O)cccc3nc12

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.69
CYP2C9 P11712 2/20 0.49
CYP1A2 P05177 1/20 0.49
MAPT P10636 1/20 0.49
CYP2C19 P33261 1/20 0.49
KDM4E B2RXH2 5/20 0.46
HPGD P15428 2/20 0.46
HSD17B10 Q99714 2/20 0.46
KMT2A Q03164 2/20 0.42
DHODH Q02127 1/20 0.42
GAA P10253 1/20 0.42
ATM Q13315 1/20 0.42
MYC P01106 1/20 0.42
CYP3A4 P08684 1/20 0.40
LMNA P02545 1/20 0.40
HTT P42858 1/20 0.40
RAB9A P51151 1/20 0.40
POLB P06746 1/20 0.39
NR4A1 P22736 1/20 0.39
NR4A2 P43354 1/20 0.39

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
SCHEMBL5448034 0.91 ALDH1A1 (0.71) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19
SCHEMBL7569010 0.91 ALDH1A1 (0.58) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19
SCHEMBL5457153 0.90 ALDH1A1 (0.69) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19
SCHEMBL30548734 0.87 ALDH1A1 (0.88) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19
SCHEMBL68995 0.87 ALDH1A1 (0.88) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19
SCHEMBL8520023 0.85 ALDH1A1 (0.63) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19
SCHEMBL7567602 0.84 ALDH1A1 (0.61) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19
SCHEMBL3557070 0.82 ALDH1A1 (0.68) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19
SCHEMBL30380388 0.82 ALDH1A1 (0.68) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19
Phenazine-1-Carboxylic Acid SCHEMBL27752237 0.82 ALDH1A1 (0.93) ALDH1A1CYP2C9CYP1A2MAPTCYP2C19

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 4 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 disclosed
US-6114332-A BACTERICIDES XENOVA LIMITED (GB) 2000-09-05 US disclosed
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