SCHEMBL7566527

SCHEMBL7566527

COC(=O)c1ccccc1Nc1c(C=O)cccc1C(F)(F)F

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
TAS2R14 Q9NYV8 3/20 0.47
PTGS2 P35354 3/20 0.45
KDM4E B2RXH2 2/20 0.44
POLB P06746 1/20 0.44
ATM Q13315 1/20 0.44
RBP4 P02753 1/20 0.44
FABP4 P15090 1/20 0.43
CLCN2 P51788 1/20 0.42
CXCR2 P25025 1/20 0.42
MAOB P27338 1/20 0.42
KMT2A Q03164 1/20 0.42
TSHR P16473 2/20 0.41
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
GLA P06280 1/20 0.40
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL8558161 0.84 TAS2R14 (0.60) MAPTALOX15TAS2R14PTGS2KDM4E
SCHEMBL7568760 0.81 PTGS2 (0.49) MAPTALOX15TAS2R14PTGS2KDM4E
SCHEMBL7029629 0.79 MAPT (0.61) MAPTALOX15PTGS2KDM4EPOLB
SCHEMBL7568046 0.76 TAS2R14 (0.54) MAPTALOX15TAS2R14KDM4EPOLB
SCHEMBL18795235 0.75 MAPT (0.42) MAPTPOLBRBP4MAOBHTT
SCHEMBL4467342 0.74 CA1 (0.44) MAPTKDM4EMAOBKMT2AHPGD
SCHEMBL45490 0.73 LMNA (0.59) MAPTALOX15KDM4EPOLBATM
SCHEMBL26930977 0.73 TAS2R14 (0.48) MAPTALOX15TAS2R14KDM4EKMT2A
SCHEMBL7573522 0.72 PTGS2 (0.53) MAPTALOX15PTGS2KDM4EPOLB
SCHEMBL16127720 0.72 GAA (0.62) MAPTALOX15KDM4EPOLBRBP4

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