SCHEMBL4766121

SCHEMBL4766121

c1ccc(Cc2nc3c(CC4CCOCC4)nc4ccccc4c3[nH]2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.42
PDE9A O76083 1/20 0.42
PDE1C Q14123 1/20 0.42
GAA P10253 2/20 0.39
MAPT P10636 1/20 0.39
PKM P14618 1/20 0.39
PARP14 Q460N5 1/20 0.38
TSHR P16473 1/20 0.36
GRIN1 Q05586 1/20 0.35
GRIN2B Q13224 1/20 0.35
MEN1 O00255 1/20 0.34
ELANE P08246 1/20 0.34
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
HTT P42858 1/20 0.34
HSD17B10 Q99714 1/20 0.34
EGFR P00533 1/20 0.34
ERBB2 P04626 1/20 0.34
PNP P00491 1/20 0.34

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
SCHEMBL5271211 0.88 IDO1 (0.37) KMT2AMAPTPARP14TSHRGRIN1
SCHEMBL4724105 0.83 TLR7 (0.44) KMT2AMAPTPARP14TSHRMEN1
SCHEMBL1959319 0.77 JAK2 (0.38) KMT2AMAPTTSHRMEN1HPGD
SCHEMBL5507582 0.73 PTGES (0.32) PARP14
SCHEMBL8576955 0.72 KMT2A (0.44) KMT2AGAAMAPTPKMMEN1
SCHEMBL4767545 0.72 PARP14 (0.35) PKMPARP14HPGDKDM4EALDH1A1
SCHEMBL8726003 0.72 KMT2A (0.54) KMT2AGAAMAPTPKMTSHR
SCHEMBL214618 0.71 ACHE (0.43) KMT2AGAAMAPTTSHRHPGD
Hydrochloric Acid SCHEMBL8723782 0.71 KMT2A (0.52) KMT2AGAAMAPTPKMKDM4E
SCHEMBL4767581 0.70 SLC2A1 (0.35) PARP14EGFR

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-1968587-A1 SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZONAPHTHYRIDINES, AND IMIDAZOPYRIDINES, COMPOSITIONS, AND METHODS Coley Pharmaceutical, Inc. (US) 2008-09-17 EP disclosed
WO-2007075468-A1 SUBSTITUTED IMIDAZOQUINOLINES, IMIDAZONAPHTHYRIDINES, AND IMIDAZOPYRIDINES, COMPOSITIONS, AND METHODS COLEY PHARMACEUTICAL GROUP, INC. (US) 2007-07-05 WO disclosed