SCHEMBL8520023

SCHEMBL8520023

Cc1ccc2nc3cccc(C(=O)O)c3nc2c1C

nearest known ligand 0.63

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.63
KDM4E B2RXH2 3/20 0.46
MAPT P10636 2/20 0.46
MAPK1 P28482 1/20 0.46
CYP2C9 P11712 3/20 0.46
CYP1A2 P05177 2/20 0.46
CYP2C19 P33261 1/20 0.46
HPGD P15428 2/20 0.42
HSD17B10 Q99714 2/20 0.42
KMT2A Q03164 3/20 0.42
MEN1 O00255 2/20 0.42
CYP3A4 P08684 2/20 0.42
AKR1B10 O60218 1/20 0.42
TRPA1 O75762 1/20 0.42
ABCB11 O95342 1/20 0.42
DHFR P00374 1/20 0.42
LMNA P02545 1/20 0.42
MPO P05164 1/20 0.42
CHRM1 P11229 1/20 0.42
AKR1B1 P15121 1/20 0.42

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
SCHEMBL7566595 0.85 ALDH1A1 (0.69) ALDH1A1KDM4EMAPTCYP2C9CYP1A2
SCHEMBL5457153 0.85 ALDH1A1 (0.69) ALDH1A1KDM4EMAPTMAPK1CYP2C9
SCHEMBL5886249 0.81 ALDH1A1 (0.58) ALDH1A1KDM4EMAPTCYP2C9CYP1A2
SCHEMBL5448034 0.80 ALDH1A1 (0.71) ALDH1A1KDM4EMAPTMAPK1CYP2C9
SCHEMBL68995 0.79 ALDH1A1 (0.88) ALDH1A1KDM4EMAPTCYP2C9CYP1A2
SCHEMBL30548734 0.79 ALDH1A1 (0.88) ALDH1A1KDM4EMAPTCYP2C9CYP1A2
SCHEMBL30380388 0.78 ALDH1A1 (0.68) ALDH1A1KDM4EMAPTCYP2C9CYP1A2
SCHEMBL3557070 0.78 ALDH1A1 (0.68) ALDH1A1KDM4EMAPTCYP2C9CYP1A2
Phenazine-1-Carboxylic Acid SCHEMBL27752237 0.78 ALDH1A1 (0.93) ALDH1A1KDM4EMAPTCYP2C9CYP1A2
SCHEMBL8411675 0.78 ALDH1A1 (0.46) ALDH1A1KDM4ECYP2C9CYP1A2HPGD

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