SCHEMBL8306723

SCHEMBL8306723

CCC1=C(C)CN(CCCc2ccc(CC(OC(C)C)C(N)=O)cc2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 2/20 0.36
PARP2 Q9UGN5 2/20 0.36
LIPG Q9Y5X9 3/20 0.33
PPARA Q07869 3/20 0.31
PPARG P37231 2/20 0.31
CNR2 P34972 1/20 0.31

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
SCHEMBL8301292 0.91 PPARG (0.37) PARP1PARP2PPARAPPARG
SCHEMBL8308029 0.82 PARP1 (0.36) PARP1PARP2
SCHEMBL8308031 0.80 PARP1 (0.35) PARP1PARP2
SCHEMBL8446636 0.77 PPARG (0.38) PPARAPPARG
SCHEMBL8306299 0.77 MMP2 (0.35) PARP1PARP2LIPGPPARAPPARG
SCHEMBL8302577 0.77 PPARG (0.41) PPARAPPARG
SCHEMBL8302072 0.77 NAAA (0.32) PARP1PARP2LIPGPPARAPPARG
SCHEMBL8307961 0.75 MEN1 (0.41)
SCHEMBL8301343 0.71 HRH3 (0.39) PPARG
SCHEMBL8306803 0.69 PPARG (0.52) PPARAPPARG

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
EP-0903343-A1 Alpha-Substituted phenylpropionic acid derivative and medicine containing the same SSP Co., Ltd. (JP) 1999-03-24 EP disclosed