SCHEMBL16147339

SCHEMBL16147339

Cc1cc(SCc2sc(-c3ccc(C(F)(F)F)c(F)c3)nc2C)ccc1O

nearest known ligand 0.71

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 17/20 0.71
PPARA Q07869 13/20 0.71
PPARG P37231 8/20 0.71
MAPT P10636 2/20 0.71
MEN1 O00255 1/20 0.71
ALDH1A1 P00352 1/20 0.71
CYP3A4 P08684 1/20 0.71
HPGD P15428 1/20 0.71
ALOX15 P16050 1/20 0.71
KMT2A Q03164 1/20 0.71
HSD17B10 Q99714 1/20 0.71
LMNA P02545 1/20 0.38
TP53 P04637 1/20 0.37
FFAR1 O14842 1/20 0.37
KIF11 P52732 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
SCHEMBL16147336 0.89 PPARD (0.73) PPARDPPARAPPARGMAPTMEN1
SCHEMBL21946955 0.88 PPARD (0.69) PPARDPPARAPPARGMAPTMEN1
SCHEMBL24238918 0.86 PPARD (0.67) PPARDPPARAPPARGMAPTMEN1
SCHEMBL2166922 0.85 PPARD (0.69) PPARDPPARAPPARGMAPTMEN1
SCHEMBL21947712 0.85 PPARD (0.66) PPARDPPARAPPARGMAPTMEN1
SCHEMBL21947717 0.85 PPARD (0.68) PPARDPPARAPPARGMAPTMEN1
SCHEMBL20482074 0.85 PPARD (0.78) PPARDPPARAPPARGMAPTMEN1
SCHEMBL21947708 0.84 PPARD (0.72) PPARDPPARAPPARGMAPTMEN1
SCHEMBL29422488 0.84 PPARD (1.00) PPARDPPARAPPARGMAPTMEN1
SCHEMBL29376887 0.84 PPARD (1.00) PPARDPPARAPPARGMAPTMEN1

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-2981522-A1 PPAR AGONISTS Salk Institute for Biological Studies (US) 2016-02-10 EP disclosed
WO-2014165827-A1 PPAR AGONISTS SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) 2014-10-09 WO disclosed