SCHEMBL5079686

SCHEMBL5079686

Nc1nc2cccc(CCCCO)c2c2[nH]c(O)nc12

nearest known ligand 0.35

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DHFR P00374 1/20 0.35
TLR8 Q9NR97 12/20 0.34
ILK Q13418 1/20 0.34
CSNK1A1 P48729 1/20 0.32
CSNK1D P48730 1/20 0.32
PRKCD Q05655 1/20 0.32
PAK1 Q13153 1/20 0.32
CAMK2B Q13554 1/20 0.32
CAMK2G Q13555 1/20 0.32
CAMK2D Q13557 1/20 0.32
TAOK1 Q7L7X3 1/20 0.32
JAK2 O60674 1/20 0.31
TERT O14746 1/20 0.31
KDM4E B2RXH2 1/20 0.31
ADORA2A P29274 1/20 0.31
ADORA2B P29275 1/20 0.31
ADORA1 P30542 1/20 0.31

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
SCHEMBL5075205 0.89 TLR8 (0.43) DHFRTLR8ILKCSNK1A1CSNK1D
SCHEMBL5076247 0.81 CCNE2 (0.30)
SCHEMBL5073660 0.78 TLR8 (0.41) DHFRTLR8
SCHEMBL6272241 0.77 TLR8 (0.48) DHFRTLR8
SCHEMBL5078799 0.75 TLR8 (0.46) DHFRTLR8
SCHEMBL18587114 0.75 TLR8 (0.46) DHFRTLR8CSNK1A1CSNK1DPRKCD
SCHEMBL5078769 0.74 MPO (0.40) DHFR
SCHEMBL18587595 0.72 TLR8 (0.46) DHFRTLR8CSNK1A1CSNK1DPRKCD
SCHEMBL18585619 0.72 TLR8 (0.52) TLR8
SCHEMBL6645194 0.72 TLR8 (0.34) DHFRTLR8CSNK1A1CSNK1DPRKCD

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