SCHEMBL5078769

SCHEMBL5078769

COc1ccc(Cc2cccc3nc(N)c4nc(O)[nH]c4c23)cc1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MPO P05164 1/20 0.40
ALDH1A1 P00352 2/20 0.40
CYP2D6 P10635 1/20 0.40
ATM Q13315 1/20 0.40
DHFR P00374 4/20 0.38
TP53 P04637 1/20 0.38
MAPT P10636 1/20 0.38
MEN1 O00255 1/20 0.37
NPC1 O15118 1/20 0.37
NFKB1 P19838 1/20 0.37
RAB9A P51151 1/20 0.37
NFKB2 Q00653 1/20 0.37
KMT2A Q03164 1/20 0.37
RELA Q04206 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
EGFR P00533 1/20 0.36
PDGFRB P09619 1/20 0.36
KDR P35968 1/20 0.36
APP P05067 1/20 0.36
LMNA P02545 1/20 0.36

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
SCHEMBL5073660 0.88 TLR8 (0.41) DHFR
SCHEMBL5078771 0.87 MAPT (0.38) MPOALDH1A1TP53MAPTMEN1
SCHEMBL5078799 0.80 TLR8 (0.46) MPODHFR
SCHEMBL28802664 0.79 ALDH1A1 (0.49) MPOALDH1A1CYP2D6ATMDHFR
SCHEMBL30779218 0.79 ALDH1A1 (0.49) MPOALDH1A1CYP2D6ATMDHFR
SCHEMBL1154859 0.75 DHFR (0.62) ALDH1A1CYP2D6ATMDHFR
SCHEMBL5075205 0.75 TLR8 (0.43) MPODHFR
Hydrochloric Acid SCHEMBL27786608 0.74 DHFR (0.61) ALDH1A1CYP2D6ATMDHFR
SCHEMBL5079686 0.74 DHFR (0.35) DHFR
SCHEMBL30779217 0.73 MAPT (0.44) ALDH1A1CYP2D6ATMDHFRTP53

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-1948173-A2 HYDROXY AND ALKOXY SUBSTITUTED 1H-IMIDAZOQUINOLINES AND METHODS Coley Pharmaceutical Group, Inc. (US) 2008-07-30 EP disclosed
WO-2007056112-A2 HYDROXY AND ALKOXY SUBSTITUTED 1H-IMIDAZOQUINOLINES AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-05-18 WO disclosed