SCHEMBL4789429

SCHEMBL4789429

Cc1cc(C(=O)CCc2sc(-c3ccccc3C(F)(F)F)nc2C(C)C)ccc1OC(=S)N(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 5/20 0.36
PPARA Q07869 5/20 0.36
PPARG P37231 2/20 0.36
WNT3A P56704 2/20 0.33
S1PR1 P21453 3/20 0.32
CTSA P10619 1/20 0.32
ALDH1A1 P00352 5/20 0.32
RAB9A P51151 3/20 0.32
NPC1 O15118 2/20 0.32
MAPT P10636 2/20 0.32
SMN1; SMN2 Q16637 2/20 0.32
POLB P06746 1/20 0.32
RECQL P46063 1/20 0.32
GPBAR1 Q8TDU6 1/20 0.32
THRA P10827 1/20 0.32
THRB P10828 1/20 0.32
LMNA P02545 1/20 0.32
HTT P42858 1/20 0.32
FFAR1 O14842 1/20 0.32
FFAR4 Q5NUL3 1/20 0.32

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
SCHEMBL4789427 0.87 PPARD (0.49) PPARDPPARAPPARGMAPT
SCHEMBL2466122 0.85 PPARD (0.45) PPARDPPARAPPARGALDH1A1MAPT
SCHEMBL2464421 0.85 PPARD (0.45) PPARDPPARAPPARGWNT3AS1PR1
SCHEMBL2466105 0.85 PPARD (0.37) PPARDPPARAPPARGWNT3AS1PR1
SCHEMBL2464201 0.84 PPARD (0.49) PPARDPPARAPPARGWNT3ACTSA
SCHEMBL2467481 0.83 PPARD (0.38) PPARDPPARAPPARGWNT3AS1PR1
SCHEMBL2463130 0.83 WNT3A (0.36) PPARDPPARAPPARGWNT3ACTSA
SCHEMBL4788692 0.83 PPARD (0.34) PPARDPPARAPPARGWNT3AALDH1A1
SCHEMBL1765993 0.82 PPARD (0.34) PPARDPPARAPPARGWNT3AS1PR1
SCHEMBL2468551 0.82 PPARA (0.41) PPARDPPARAPPARGWNT3AS1PR1

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-2008154023-A1 NOVEL USES OF PPAR DELTA AGONISTS CERENIS THERAPEUTICS S.A. (FR) 2008-12-18 WO disclosed