SCHEMBL7103567

SCHEMBL7103567

Cc1ccc([N+](=O)[O-])cc1NC(=O)Nc1ccc(Oc2ccc3[nH]c(NC(=O)O)nc3c2)cc1

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.51
POLB P06746 2/20 0.51
ALDH1A1 P00352 1/20 0.51
KDR P35968 9/20 0.49
TEK Q02763 8/20 0.49
RAF1 P04049 2/20 0.49
MEN1 O00255 5/20 0.48
KMT2A Q03164 5/20 0.48
MAPK1 P28482 3/20 0.48
NPSR1 Q6W5P4 2/20 0.48
MYOC Q99972 2/20 0.48
NPC1 O15118 1/20 0.48
RAB9A P51151 1/20 0.48
LMNA P02545 1/20 0.45
HTT P42858 1/20 0.45
KCNH2 Q12809 1/20 0.44
IRAK4 Q9NWZ3 1/20 0.44

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
SCHEMBL7103564 1.00 MAPT (0.51) MAPTPOLBALDH1A1KDRTEK
SCHEMBL5347951 0.93 KDR (0.57) MAPTPOLBALDH1A1KDRTEK
SCHEMBL7101458 0.90 KDR (0.56) MAPTKDRTEKRAF1MEN1
SCHEMBL7101462 0.90 KDR (0.56) MAPTKDRTEKRAF1MEN1
SCHEMBL7011747 0.86 MAPT (0.51) MAPTPOLBALDH1A1KDRTEK
SCHEMBL7011752 0.86 MAPT (0.51) MAPTPOLBALDH1A1KDRTEK
SCHEMBL5346740 0.84 TEK (0.68) MAPTKDRTEKRAF1MEN1
SCHEMBL5341763 0.80 TEK (0.53) MAPTPOLBALDH1A1KDRTEK
SCHEMBL7011703 0.78 NTRK1 (0.55) MAPTPOLBKDRTEKRAF1
SCHEMBL7017823 0.78 KDR (0.62) MAPTKDRTEKRAF1NPC1

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-1341771-A2 BENZIMIDAZOLE DERIVATIVES USEFUL AS TIE-2 AND/OR VEGFR-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2003-09-10 EP claimed
WO-2002044156-A2 BENZIMIDAZOLE DERIVATIVES USEFUL AS TIE-2 AND/OR VEGFR-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2002-06-06 WO claimed
EP-1341771-A2 BENZIMIDAZOLE DERIVATIVES USEFUL AS TIE-2 AND/OR VEGFR-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2003-09-10 EP disclosed
WO-2002044156-A2 BENZIMIDAZOLE DERIVATIVES USEFUL AS TIE-2 AND/OR VEGFR-2 INHIBITORS GLAXO GROUP LIMITED (GB) 2002-06-06 WO disclosed