SCHEMBL7569010

SCHEMBL7569010

Cc1ccc(Cl)c2nc3cccc(C(=O)O)c3nc12

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.58
CYP1A2 P05177 2/20 0.43
MAPT P10636 2/20 0.43
CYP2C9 P11712 2/20 0.43
CYP2C19 P33261 2/20 0.43
KMT2A Q03164 4/20 0.41
MEN1 O00255 3/20 0.41
TTR P02766 2/20 0.41
ADORA3 P0DMS8 2/20 0.41
PTGS2 P35354 2/20 0.41
AKR1C3 P42330 2/20 0.41
AKR1B10 O60218 1/20 0.41
ABCB11 O95342 1/20 0.41
CHRM1 P11229 1/20 0.41
FABP2 P12104 1/20 0.41
RXRA P19793 1/20 0.41
TBXA2R P21731 1/20 0.41
NR4A1 P22736 1/20 0.41
PTGS1 P23219 1/20 0.41
PDE4A P27815 1/20 0.41

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 0.91 ALDH1A1 (0.69) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL7568127 0.83 ALDH1A1 (0.71) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL5448034 0.83 ALDH1A1 (0.71) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL5457153 0.82 ALDH1A1 (0.69) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL7572097 0.82 ALDH1A1 (0.69) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL68995 0.79 ALDH1A1 (0.88) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL30548734 0.79 ALDH1A1 (0.88) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL8520023 0.78 ALDH1A1 (0.63) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL7566364 0.77 RAD52 (0.45) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19
SCHEMBL7567602 0.77 ALDH1A1 (0.61) ALDH1A1CYP1A2MAPTCYP2C9CYP2C19

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