SCHEMBL3975005

SCHEMBL3975005

CC(O)c1ccccc1-c1ccc2cccnc2c1OCc1ccccc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.42
LMNA P02545 3/20 0.40
TSHR P16473 2/20 0.40
HTT P42858 2/20 0.40
ALDH1A1 P00352 2/20 0.40
HPGD P15428 1/20 0.40
MAPK1 P28482 1/20 0.40
CYP3A4 P08684 2/20 0.40
P4HB P07237 1/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
POLB P06746 1/20 0.39
SLC2A1 P11166 2/20 0.38
FNTA P49354 1/20 0.37
FNTB P49356 1/20 0.37
MAPT P10636 3/20 0.37
TP53 P04637 2/20 0.37
KDM4E B2RXH2 2/20 0.37
GMNN O75496 1/20 0.37
HSP90AA1 P07900 1/20 0.37

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
SCHEMBL3975011 0.78 EGLN1 (0.43) EGLN1LMNATSHRHTTALDH1A1
SCHEMBL1758872 0.73 BCHE (0.46) HPGDMAPTKDM4ESMN1; SMN2RAB9A
SCHEMBL1507742 0.72 RAB9A (0.55) EGLN1LMNAMAPK1CYP3A4MEN1
SCHEMBL1813245 0.71 EGLN1 (0.44) EGLN1LMNATSHRHTTALDH1A1
SCHEMBL1814575 0.71 EGLN1 (0.44) EGLN1LMNATSHRHTTALDH1A1
SCHEMBL12472139 0.71 EGLN1 (0.61) EGLN1LMNAALDH1A1CYP3A4MEN1
SCHEMBL1637949 0.71 MAPK1 (0.46) LMNATSHRHTTALDH1A1HPGD
SCHEMBL14649475 0.70 CYP3A4 (0.47) EGLN1LMNATSHRHTTALDH1A1
SCHEMBL21801714 0.69 BRD4 (0.53) EGLN1ALDH1A1MAPTKDM4ETDP1
SCHEMBL17541529 0.69 MMP2 (0.52) LMNATSHRHTTALDH1A1MAPK1

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-2056823-A2 8-HYDROXYQUINOLINE COMPOUNDS AND METHODS THEREOF Wyeth (US) 2009-05-13 EP disclosed
WO-2008024922-A2 8-HYDROXYQUINOLINE COMPOUNDS AND METHODS THEREOF WYETH (US) 2008-02-28 WO disclosed