SCHEMBL8306093

SCHEMBL8306093

CCOC(Cc1ccc(CCCN2CCN(C)CCC2=O)cc1)C(N)=O

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PPARG P37231 9/20 0.39
POLB P06746 1/20 0.38
PPARA Q07869 10/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
PPARD Q03181 1/20 0.36
ALDH1A1 P00352 1/20 0.35
GAA P10253 1/20 0.34

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
SCHEMBL8304487 0.91 PPARG (0.48) PPARGPPARAPPARD
SCHEMBL8305544 0.86 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL8302764 0.86 ALDH1A1 (0.50) POLBNPC1RAB9AMEN1KMT2A
SCHEMBL6956670 0.80 PPARG (0.43) PPARGMEN1KMT2A
SCHEMBL8307961 0.79 MEN1 (0.41) NPC1RAB9AMEN1KMT2ASLC6A2
SCHEMBL8303961 0.77 ALDH1A1 (0.52) PPARGPPARANPC1RAB9AMEN1
SCHEMBL8302884 0.76 PPARG (0.62) PPARGPPARAPPARD
SCHEMBL8307977 0.76 PPARG (0.51) PPARGPPARAPPARD
SCHEMBL6952012 0.73 PPARG (0.38) PPARGPPARAPPARD
SCHEMBL8301593 0.73 PPARG (0.51) PPARGPPARANPC1RAB9AMEN1

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