SCHEMBL1287166

SCHEMBL1287166

Fc1ccc(COCCl)cc1

nearest known ligand 0.54

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 3/20 0.54
AGXT P21549 2/20 0.54
MAOB P27338 6/20 0.44
APP P05067 1/20 0.44
LOXL2 Q9Y4K0 1/20 0.42
TAAR1 Q96RJ0 1/20 0.39
NR4A2 P43354 1/20 0.39

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
SCHEMBL14947971 0.87 TSHR (0.48) IDO1AGXTAPP
SCHEMBL7888039 0.85 IDO1 (0.64) IDO1AGXTMAOBAPPLOXL2
SCHEMBL7219594 0.78 IDO1 (0.56) IDO1AGXTMAOBAPPTAAR1
Hydroxyamine SCHEMBL8923579 0.78 IDO1 (0.62) IDO1AGXTMAOBAPPLOXL2
SCHEMBL22304854 0.78 IDO1 (0.56) IDO1AGXTMAOBAPPLOXL2
SCHEMBL6542140 0.77 TAAR1 (0.46) IDO1AGXTMAOBLOXL2TAAR1
SCHEMBL4343354 0.76 TSHR (0.71) IDO1AGXT
SCHEMBL7213285 0.76 AGXT (0.54) IDO1AGXTMAOBTAAR1
SCHEMBL883828 0.76 IDO1 (0.54) IDO1AGXTMAOBAPPLOXL2
Hydrochloric Acid SCHEMBL29116870 0.76 IDO1 (0.58) IDO1AGXTMAOBAPPLOXL2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2012047993-A2 N-HYDROXYPYRIMIDINE-2,4-DIONES AS INHIBITORS OF HIV AND HCV REGENTS OF THE UNIVERSITY OF MINNESOTA (US) 2012-04-12 WO disclosed